Mercurial > repos > lecorguille > camera_annotate

annotate test-data/faahKO.xset.group.retcor.group.fillPeaks.annotate.variableMetadata.tsv @ 9:7da9252dd983 draft

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planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
author lecorguille
date Mon, 25 Apr 2016 11:06:25 -0400
parents
children 1c30ff90f3ae
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
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1 name mz mzmin mzmax rt rtmin rtmax npeaks KO WT isotopes adduct pcgroup fold tstat pvalue
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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452 M233T3472 232.900009155273 232.900009155273 232.900009155273 3471.51183376243 3471.51183376243 3471.51183376243 1 0 1 31 Inf 1 0.5
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lecorguille
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lecorguille
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456 M233T3326 232.900009155273 232.900009155273 232.900009155273 3325.93252629622 3325.93252629622 3325.93252629622 1 0 1 1084 2.07643822626217 0.648503614600873 0.587492146865549
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lecorguille
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lecorguille
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463 M233T3962 233.300003051758 233.300003051758 233.300003051758 3961.66776334958 3961.66776334958 3961.66776334958 1 0 1 6130 2.6935616771446 0.58943410131316 0.643031353710827
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lecorguille
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lecorguille
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465 M234T2660 233.800003051758 233.800003051758 233.800003051758 2659.95963918267 2659.95963918267 2659.95963918267 1 0 1 2263 Inf 1 0.5
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lecorguille
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466 M234T3294 233.800003051758 233.800003051758 233.800003051758 3294.41613836096 3294.41613836096 3294.41613836096 1 0 1 5979 Inf 1 0.5
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lecorguille
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467 M234T3005 233.800003051758 233.800003051758 233.800003051758 3005.15885258136 3005.15885258136 3005.15885258136 1 0 1 4099 Inf 1 0.5
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lecorguille
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468 M234T2702 233.900009155273 233.900009155273 233.900009155273 2701.64547937692 2701.64547937692 2701.64547937692 1 1 0 4857 1.03579717036527 -0.0248634883551241 0.982424046480909
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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473 M234T3259 233.900009155273 233.900009155273 233.900009155273 3259.11729695133 3259.11729695133 3259.11729695133 1 0 1 3593 Inf 3.6930605808871 0.168345785429204
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lecorguille
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lecorguille
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lecorguille
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476 M234T3782 234.100006103516 234.100006103516 234.100006103516 3781.72876897582 3781.72876897582 3781.72876897582 1 0 1 3664 Inf 1 0.5
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lecorguille
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lecorguille
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lecorguille
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484 M234T3634 234.5 234.5 234.5 3633.9295464167 3633.9295464167 3633.9295464167 1 0 1 2360 Inf 1 0.5
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485 M234T4014 234.5 234.5 234.5 4013.55675068288 4013.55675068288 4013.55675068288 1 0 1 5206 Inf 1 0.5
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486 M235T3771 234.800003051758 234.800003051758 234.800003051758 3770.9212916113 3770.9212916113 3770.9212916113 1 1 0 13 1.35198682579853 0.209313294453108 0.855042523604007
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488 M235T3321 234.900009155273 234.900009155273 234.900009155273 3321.03357088832 3321.03357088832 3321.03357088832 1 1 0 1134 1.75815404650145 -0.539081132064723 0.643818392786798
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500 M236T3708 235.800003051758 235.800003051758 235.800003051758 3707.50009205663 3707.50009205663 3707.50009205663 1 0 1 1168 Inf 1 0.5
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501 M236T3772 235.800003051758 235.800003051758 235.800003051758 3772.21824064541 3772.21824064541 3772.21824064541 1 0 1 13 8.72704176573959 3.51428038371953 0.108727545216414
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502 M236T3936 235.900009155273 235.900009155273 235.900009155273 3936.43507866832 3936.43507866832 3936.43507866832 1 0 1 4137 Inf 3.16381189555264 0.194893475044962
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
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1006 M267T3590 267.300018310547 267.300018310547 267.300018310547 3590.18495990216 3590.18495990216 3590.18495990216 1 1 0 28 Inf -1 0.5
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1009 M268T4099 267.899993896484 267.899993896484 267.899993896484 4098.98660063081 4098.98660063081 4098.98660063081 1 0 1 5090 Inf 1 0.5
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1010 M268T2779 267.899993896484 267.899993896484 267.899993896484 2779.21826702778 2779.21826702778 2779.21826702778 1 0 1 4273 Inf 1 0.5
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1011 M268T3790 267.899993896484 267.899993896484 267.899993896484 3789.65430237007 3789.65430237007 3789.65430237007 1 0 1 4449 Inf 1 0.5
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1012 M268T2742 267.899993896484 267.899993896484 267.899993896484 2742.32168716591 2742.32168716591 2742.32168716591 1 0 1 4596 Inf 1 0.5
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1013 M268T3905 268 268 268 3905.20958329281 3905.20958329281 3905.20958329281 1 1 0 4813 4.83710675278951 -1.3619788286965 0.364267639114777
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1015 M268T3229 268 268 268 3228.92889420406 3228.92889420406 3228.92889420406 1 0 1 2707 1.83464365394071 0.739705079693348 0.557314708556316
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lecorguille
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1016 M268T3670 268.100006103516 268.100006103516 268.100006103516 3670.13231198944 3666.72439172897 3673.5402322499 2 1 1 [5][M+1]- 2 1.74579759529771 -0.821039007252816 0.515859205830175
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lecorguille
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1017 M268T4139 268.100006103516 268.100006103516 268.100006103516 4139.30926202987 4139.30926202987 4139.30926202987 1 0 1 3952 1.35442773428554 0.348421208879889 0.762428385955594
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lecorguille
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1018 M268T3902 268.100006103516 268.100006103516 268.100006103516 3902.32530367382 3902.32530367382 3902.32530367382 1 0 1 4794 10.5090856252359 1.09266770603887 0.471161666348724
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lecorguille
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1019 M268T3874 268.200012207031 268.200012207031 268.200012207031 3874.41735377361 3873.18822164528 3875.64648590193 2 1 1 55 10.2959322633176 0.902155766257439 0.531348450610317
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lecorguille
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1020 M268T3665 268.200012207031 268.200012207031 268.200012207031 3664.65842581541 3662.48141079097 3666.83544083985 2 0 2 [6][M+1]- 2 1.54700271029731 1.92227252023786 0.271227371173362
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lecorguille
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1021 M268T2684 268.200012207031 268.200012207031 268.200012207031 2684.06586984756 2684.06586984756 2684.06586984756 1 0 1 642 2.61204765950841 0.576364148782152 0.648788870950634
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lecorguille
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lecorguille
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lecorguille
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1024 M268T4177 268.200012207031 268.200012207031 268.200012207031 4177.13473042771 4177.13473042771 4177.13473042771 1 1 0 [M-H+Cl]2- 502.433 [M-2H]2- 538.409 115 2.06455004338012 -0.464061479732068 0.702880904592812
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1025 M268T2696 268.300018310547 268.300018310547 268.300018310547 2696.11125423261 2696.11125423261 2696.11125423261 1 1 0 5068 Inf -1 0.5
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lecorguille
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1026 M268T2933 268.300018310547 268.300018310547 268.300018310547 2933.01639058469 2933.01639058469 2933.01639058469 1 0 1 3622 Inf 1 0.5
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lecorguille
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1027 M268T3716 268.300018310547 268.300018310547 268.300018310547 3715.67042009322 3715.67042009322 3715.67042009322 1 1 0 1171 Inf -1 0.5
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lecorguille
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1028 M268T3616 268.300018310547 268.300018310547 268.300018310547 3616.14153100784 3616.14153100784 3616.14153100784 1 0 1 2566 1.79826234543484 -0.850677263183171 0.529095261202237
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lecorguille
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1029 M268T4038 268.399993896484 268.399993896484 268.399993896484 4038.4655434023 4038.4655434023 4038.4655434023 1 0 1 3757 Inf 1 0.5
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lecorguille
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1030 M268T4122 268.399993896484 268.399993896484 268.399993896484 4122.06642147928 4122.06642147928 4122.06642147928 1 1 0 1710 Inf -1 0.5
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lecorguille
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1031 M269T2975 269 269 269 2975.1158352874 2972.99959761349 2977.23207296132 2 1 1 211 1.12875018382789 0.10530671976527 0.926700056666813
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lecorguille
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1034 M269T3593 269 269 269 3593.31657212235 3593.31657212235 3593.31657212235 1 1 0 5882 2.52256829891465 -0.797577780194182 0.523057377138374
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1041 M269T3098 269.200012207031 269.200012207031 269.200012207031 3097.59855190873 3097.59855190873 3097.59855190873 1 1 0 5360 3.20898578936128 -0.657203732162942 0.614859077738468
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lecorguille
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lecorguille
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1043 M269T3863 269.200012207031 269.200012207031 269.200012207031 3862.52057125727 3862.52057125727 3862.52057125727 1 1 0 [9][M]- 21 1.78380473042388 0.580149086446334 0.662647145296578
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1044 M269T3079 269.200012207031 269.200012207031 269.200012207031 3078.62250815209 3078.62250815209 3078.62250815209 1 0 1 3521 Inf 1 0.5
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
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1046 M269T3528 269.300018310547 269.300018310547 269.300018310547 3528.25736576243 3528.25736576243 3528.25736576243 1 1 0 384 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
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1047 M269T4183 269.399993896484 269.399993896484 269.399993896484 4183.25070224548 4183.25070224548 4183.25070224548 1 1 0 5996 Inf -1 0.5
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1048 M270T4182 269.899993896484 269.899993896484 269.899993896484 4182.40649337683 4182.40649337683 4182.40649337683 1 0 1 5993 Inf 3.5492338886735 0.174835915630843
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1049 M270T2950 269.899993896484 269.899993896484 269.899993896484 2950.139046458 2950.139046458 2950.139046458 1 1 0 [M-H]- 270.905 70 Inf -1 0.5
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1050 M270T4102 270 270 270 4101.61123303705 4101.61123303705 4101.61123303705 1 1 0 5807 Inf -1 0.5
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1052 M270T3864 270.100006103516 270.100006103516 270.100006103516 3863.89744476375 3863.89744476375 3870.40838927407 3 1 1 [7][M+1]- 1361 1.71187159972158 1.12028004065292 0.399747704359597
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1053 M270T3266 270.100006103516 270.100006103516 270.100006103516 3265.5145445779 3265.5145445779 3265.5145445779 1 0 1 85 1.01305239651347 0.0168891009719796 0.988058572477875
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1054 M270T3574 270.100006103516 270.100006103516 270.100006103516 3574.18902045403 3574.18902045403 3574.18902045403 1 1 0 1638 2.15337695428517 -0.914563488326964 0.510681844781173
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1055 M270T3876 270.200012207031 270.200012207031 270.200012207031 3875.98745631447 3874.75776665632 3877.21714597262 2 1 1 [8][M+1]- 55 1.79247535185128 0.457843164185477 0.718121160745196
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1056 M270T3861 270.200012207031 270.200012207031 270.200012207031 3860.94388545761 3860.94388545761 3860.94388545761 1 1 0 [9][M+1]- 21 1.20573205135982 0.226156249940276 0.855756371092973
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1057 M270T3142 270.200012207031 270.200012207031 270.200012207031 3141.63273957229 3141.63273957229 3141.63273957229 1 0 1 [M-H]- 271.206 [M-H-NH3]- 288.233 67 3.97821519790383 1.46294246477593 0.311175511045113
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1058 M270T3593 270.200012207031 270.200012207031 270.200012207031 3593.31657212235 3593.31657212235 3593.31657212235 1 1 0 5883 4.71021240027919 -1.0106251216283 0.477516939590944
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1059 M270T3695 270.300018310547 270.300018310547 270.300018310547 3694.98442994032 3694.98442994032 3694.98442994032 1 0 1 585 Inf 1 0.5
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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1122 M274T4031 274.399993896484 274.399993896484 274.399993896484 4031.20748113412 4031.20748113412 4031.20748113412 1 1 0 3758 Inf -1 0.5
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lecorguille
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lecorguille
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lecorguille
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1128 M275T2852 274.899993896484 274.899993896484 274.899993896484 2851.80289232176 2851.80289232176 2851.80289232176 1 1 0 4252 Inf -1 0.5
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1129 M275T3531 274.899993896484 274.899993896484 274.899993896484 3530.8102348298 3530.8102348298 3530.8102348298 1 1 0 1946 5.20301205225027 -0.793284751472928 0.565539349390432
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1130 M275T3358 274.899993896484 274.899993896484 274.899993896484 3357.81958398463 3357.81958398463 3357.81958398463 1 0 1 718 Inf 1 0.5
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1139 M275T2711 275.200012207031 275.200012207031 275.200012207031 2710.92356693602 2710.92356693602 2710.92356693602 1 1 0 2470 2.31853188555693 -0.522192274822415 0.673833905108404
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lecorguille
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lecorguille
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lecorguille
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1143 M275T3697 275.300018310547 275.300018310547 275.300018310547 3697.15922176977 3697.15922176977 3697.15922176977 1 0 1 5480 Inf 1 0.5
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lecorguille
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lecorguille
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lecorguille
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1147 M275T3966 275.300018310547 275.300018310547 275.300018310547 3966.39877145841 3966.39877145841 3966.39877145841 1 0 1 2011 4.44436469456916 0.756092968281861 0.578215970770996
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lecorguille
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lecorguille
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1149 M276T3340 275.800018310547 275.800018310547 275.800018310547 3340.11027916033 3340.11027916033 3340.11027916033 1 0 1 5509 Inf 1 0.5
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lecorguille
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1150 M276T3077 275.899993896484 275.899993896484 275.899993896484 3076.98339324883 3076.98339324883 3076.98339324883 1 1 0 182 Inf -1 0.5
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lecorguille
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1151 M276T3716 275.899993896484 275.899993896484 275.899993896484 3715.67042009322 3715.67042009322 3715.67042009322 1 1 0 1172 Inf -1 0.5
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lecorguille
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1152 M276T3765 275.899993896484 275.899993896484 275.899993896484 3764.54207690721 3764.54207690721 3764.54207690721 1 1 0 970 1.57718181856556 0.36594957580485 0.750670971803501
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lecorguille
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1153 M276T3867 275.899993896484 275.899993896484 275.899993896484 3866.89893599656 3866.89893599656 3866.89893599656 1 1 0 21 8.82318014421633 -0.95188537808119 0.5119541454644
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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1158 M276T4005 276.200012207031 276.200012207031 276.200012207031 4005.24194327753 4005.24194327753 4005.24194327753 1 1 0 217 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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1160 M276T3959 276.200012207031 276.200012207031 276.200012207031 3958.51372979809 3958.51372979809 3958.51372979809 1 0 1 5452 3.02642514835286 0.635769603546046 0.623474327254434
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lecorguille
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1161 M276T3732 276.300018310547 276.300018310547 276.300018310547 3731.60167054542 3731.60167054542 3731.60167054542 1 0 1 3552 5.0014029801698 0.784528017757216 0.568479400212192
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lecorguille
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1162 M276T3768 276.300018310547 276.300018310547 276.300018310547 3767.73011661427 3767.73011661427 3767.73011661427 1 1 0 971 Inf -1.62486149527902 0.351218690599776
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lecorguille
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lecorguille
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1164 M276T3561 276.300018310547 276.300018310547 276.300018310547 3561.30537731107 3561.30537731107 3561.30537731107 1 1 0 1654 2.83772692601012 -1.2722813037795 0.331369829791931
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1165 M276T3697 276.399993896484 276.399993896484 276.399993896484 3696.96417543909 3696.96417543909 3696.96417543909 1 1 0 5481 13.8335085526949 -1.02067352860629 0.491787891203815
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1166 M276T3521 276.399993896484 276.399993896484 276.399993896484 3521.34042635036 3521.34042635036 3521.34042635036 1 0 1 387 Inf 1 0.5
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1167 M276T3666 276.399993896484 276.399993896484 276.399993896484 3665.85204372625 3665.85204372625 3665.85204372625 1 1 0 444 4.34403176655601 -0.75017877580323 0.58028035937144
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1168 M276T2581 276.399993896484 276.399993896484 276.399993896484 2581.23728676082 2581.23728676082 2581.23728676082 1 1 0 5684 Inf -1 0.5
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1169 M276T3327 276.5 276.5 276.5 3327.335343408 3327.335343408 3327.335343408 1 1 0 1093 2.48118491312848 -0.59348735144104 0.657169634989045
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1170 M276T3683 276.5 276.5 276.5 3683.30909609627 3683.30909609627 3683.30909609627 1 1 0 5 Inf -1 0.5
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1171 M276T4012 276.5 276.5 276.5 4012.12563508159 4012.12563508159 4012.12563508159 1 0 1 5239 3.99949134182788 0.72757058581422 0.588308093979749
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1172 M277T3102 276.600006103516 276.600006103516 276.600006103516 3102.2333686911 3102.2333686911 3102.2333686911 1 1 0 3128 Inf -1 0.5
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1173 M277T3312 276.700012207031 276.700012207031 276.700012207031 3311.73062117219 3311.73062117219 3311.73062117219 1 0 1 517 Inf 1 0.5
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1174 M277T3547 276.700012207031 276.700012207031 276.700012207031 3547.24521550954 3547.24521550954 3547.24521550954 1 1 0 2323 Inf -1 0.5
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1175 M277T3992 276.700012207031 276.700012207031 276.700012207031 3991.62863021708 3991.62863021708 3991.62863021708 1 0 1 4488 Inf 1 0.5
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1176 M277T3279 276.800018310547 276.800018310547 276.800018310547 3278.59145142642 3278.59145142642 3278.59145142642 1 1 0 1235 Inf -1.58356174514294 0.358576810571612
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1177 M277T3291 276.800018310547 276.800018310547 276.800018310547 3291.26753919816 3291.26753919816 3291.26753919816 1 0 1 2104 Inf 1 0.5
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1179 M277T3838 277.100006103516 277.100006103516 277.100006103516 3838.46700647391 3835.10997133013 3841.8240416177 2 1 1 69 2.30364434978435 1.09297615167006 0.39189056405863
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1180 M277T3506 277.100006103516 277.100006103516 277.100006103516 3505.77314021334 3505.77314021334 3505.77314021334 1 0 1 3362 1.41197580812843 -0.411982276563362 0.720480929097793
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1181 M277T2536 277.100006103516 277.100006103516 277.100006103516 2535.707668269 2535.707668269 2535.707668269 1 0 1 210 1.57925710750348 -0.30988933241459 0.790580195782676
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1182 M277T4183 277.100006103516 277.100006103516 277.100006103516 4183.25070224548 4183.25070224548 4183.25070224548 1 1 0 5997 1.04995728766621 0.034454036762898 0.975651118492605
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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1194 M277T4036 277.399993896484 277.399993896484 277.399993896484 4035.91610993249 4035.91610993249 4035.91610993249 1 1 0 3760 Inf -1 0.5
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lecorguille
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1196 M278T3332 277.600006103516 277.600006103516 277.600006103516 3332.0549965256 3332.0549965256 3332.0549965256 1 1 0 1094 Inf -1 0.5
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1197 M278T3523 277.600006103516 277.600006103516 277.600006103516 3522.87194622765 3522.87194622765 3522.87194622765 1 1 0 388 Inf -1 0.5
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1198 M278T4085 277.800018310547 277.800018310547 277.800018310547 4085.03207935327 4085.03207935327 4085.03207935327 1 0 1 5718 Inf 1 0.5
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1199 M278T3716 277.899993896484 277.899993896484 277.899993896484 3715.65886287413 3714.40967183111 3716.90805391716 2 1 1 1154 1.3403988829023 -0.249677481277401 0.842160829563736
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1200 M278T2908 277.899993896484 277.899993896484 277.899993896484 2908.26668636657 2908.26668636657 2908.26668636657 1 1 0 2766 Inf -1 0.5
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1201 M278T2568 277.899993896484 277.899993896484 277.899993896484 2568.42497459635 2568.42497459635 2568.42497459635 1 1 0 5292 Inf -1 0.5
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1202 M278T2634 277.899993896484 277.899993896484 277.899993896484 2633.74691936957 2633.74691936957 2633.74691936957 1 0 1 2615 Inf 1 0.5
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lecorguille
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1203 M278T3760 277.899993896484 277.899993896484 277.899993896484 3759.66571973942 3759.66571973942 3759.66571973942 1 0 1 936 1.15587604814462 0.101985486501817 0.928242218191103
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lecorguille
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1204 M278T3619 277.899993896484 277.899993896484 277.899993896484 3618.62698531311 3618.62698531311 3618.62698531311 1 1 0 [M+Cl]- 242.929 [M-H]- 278.911 2561 Inf -1 0.5
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lecorguille
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1205 M278T3957 277.899993896484 277.899993896484 277.899993896484 3957.41697160807 3957.41697160807 3957.41697160807 1 1 0 5393 Inf -1 0.5
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lecorguille
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1206 M278T3043 277.899993896484 277.899993896484 277.899993896484 3042.93368221238 3042.93368221238 3042.93368221238 1 0 1 3210 Inf 1 0.5
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lecorguille
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1207 M278T3192 278.100006103516 278.100006103516 278.100006103516 3192.25229568686 3192.00991294654 3192.49467842718 2 1 1 30 17.3181117977187 -0.940690038811295 0.518615777448511
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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1212 M278T3836 278.200012207031 278.200012207031 278.200012207031 3836.30357926608 3836.30357926608 3836.30357926608 1 0 1 3350 3.56438330077236 0.79347855863702 0.56183549835805
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lecorguille
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1213 M278T3275 278.200012207031 278.200012207031 278.200012207031 3274.99853643994 3274.99853643994 3274.99853643994 1 0 1 5011 2.8101518150515 1.04507700249181 0.48071825947269
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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1215 M278T2678 278.300018310547 278.300018310547 278.300018310547 2678.04389510041 2678.04389510041 2678.04389510041 1 1 0 643 Inf -1 0.5
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lecorguille
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1216 M278T3609 278.300018310547 278.300018310547 278.300018310547 3608.53366078857 3608.53366078857 3608.53366078857 1 0 1 4671 Inf 1 0.5
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lecorguille
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1217 M278T4018 278.300018310547 278.300018310547 278.300018310547 4018.23186265825 4018.23186265825 4018.23186265825 1 0 1 6207 Inf 1 0.5
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lecorguille
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1218 M278T3382 278.300018310547 278.300018310547 278.300018310547 3382.01892208389 3382.01892208389 3382.01892208389 1 1 0 25 Inf -1.12922091544523 0.461411325111997
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1219 M278T3141 278.399993896484 278.399993896484 278.399993896484 3140.87578531608 3140.87578531608 3140.87578531608 1 0 1 3115 1.32210660895519 0.19430947004286 0.865047228114449
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lecorguille
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1220 M278T3953 278.399993896484 278.399993896484 278.399993896484 3952.71732473982 3952.71732473982 3952.71732473982 1 1 0 5448 Inf -1 0.5
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lecorguille
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1221 M278T3157 278.399993896484 278.399993896484 278.399993896484 3156.97426443286 3156.97426443286 3156.97426443286 1 1 0 826 Inf -1 0.5
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lecorguille
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1222 M279T4163 278.800018310547 278.800018310547 278.800018310547 4162.55904654218 4162.55904654218 4162.55904654218 1 0 1 6034 Inf 1 0.5
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lecorguille
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1223 M279T4059 278.899993896484 278.899993896484 278.899993896484 4058.65996267593 4058.65996267593 4058.65996267593 1 0 1 4690 2.45227520174755 0.590465414185366 0.659505455855004
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lecorguille
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1224 M279T3775 278.899993896484 278.899993896484 278.899993896484 3774.53646135478 3774.53646135478 3774.53646135478 1 1 0 221 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1225 M279T2577 278.899993896484 278.899993896484 278.899993896484 2577.24608488001 2577.24608488001 2577.24608488001 1 0 1 4070 Inf 1 0.5
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lecorguille
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lecorguille
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1228 M279T4466 279.100006103516 279.100006103516 279.100006103516 4466.04715089905 4466.04715089905 4466.04715089905 1 0 1 330 Inf 1 0.5
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1229 M279T3219 279.100006103516 279.100006103516 279.100006103516 3219.3648035471 3219.3648035471 3219.3648035471 1 1 0 4281 1.10815151989387 0.178780601448165 0.874589779680826
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
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1230 M279T3353 279.200012207031 279.200012207031 279.200012207031 3353.0327267314 3353.0327267314 3353.0327267314 1 0 1 719 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
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1231 M279T3547 279.200012207031 279.200012207031 279.200012207031 3546.98944553125 3546.98944553125 3546.98944553125 1 0 1 2334 Inf 1 0.5
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1232 M279T3978 279.200012207031 279.200012207031 279.200012207031 3977.60008277685 3977.60008277685 3977.60008277685 1 0 1 1995 Inf 1 0.5
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1233 M279T3251 279.300018310547 279.300018310547 279.300018310547 3251.13198122451 3251.13198122451 3251.13198122451 1 1 0 34 1.47264696100685 -0.380626352075122 0.748322391012691
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1234 M279T3256 279.399993896484 279.399993896484 279.399993896484 3255.51329750227 3255.08398772709 3255.94260727745 2 1 1 34 1.5105242684877 0.281817553645077 0.808070653982
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1235 M279T4454 279.399993896484 279.399993896484 279.399993896484 4454.31322276304 4454.31322276304 4454.31322276304 1 1 0 295 Inf -1 0.5
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1236 M280T3259 279.800018310547 279.800018310547 279.800018310547 3259.11729695133 3259.11729695133 3259.11729695133 2 0 1 3597 3.06875069147841 0.640961601866007 0.621363200539613
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1237 M280T3916 279.800018310547 279.800018310547 279.800018310547 3916.30780579745 3916.30780579745 3916.30780579745 1 1 0 5136 Inf -1 0.5
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1238 M280T3883 279.800018310547 279.800018310547 279.800018310547 3883.04786546855 3883.04786546855 3883.04786546855 1 1 0 2228 9.46577705954494 -0.889406884525449 0.534594656486317
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1239 M280T3513 279.899993896484 279.899993896484 279.899993896484 3512.86668693309 3512.86668693309 3512.86668693309 1 0 1 4518 Inf 1.44430252742341 0.38553098033375
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1240 M280T4118 279.899993896484 279.899993896484 279.899993896484 4117.72633782937 4117.72633782937 4117.72633782937 1 0 1 4549 Inf 2.18185763472335 0.27359080410272
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1241 M280T2791 280 280 280 2790.51913451326 2787.4613789788 2791.37244185306 4 2 2 [11][M+1]- 12 1.11347701899179 -0.495084550733494 0.682763480685249
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1243 M280T4202 280 280 280 4202.03128531258 4202.03128531258 4202.03128531258 1 1 0 5696 Inf -1 0.5
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1244 M280T4171 280 280 280 4170.85203292154 4170.85203292154 4170.85203292154 1 1 0 5922 Inf -1 0.5
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1245 M280T3396 280 280 280 3395.92903288707 3395.92903288707 3395.92903288707 1 1 0 472 Inf -1 0.5
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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1307 M283T3662 283.200012207031 283.200012207031 283.200012207031 3662.1658318981 3657.49622295636 3666.83544083985 2 1 1 [12][M+2]- 2 1.17379528518731 1.32784938177119 0.37343762143275
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1314 M283T3031 283.200012207031 283.200012207031 283.200012207031 3031.46173389346 3031.46173389346 3031.46173389346 1 1 0 2138 Inf -1 0.5
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1320 M284T3861 284.200012207031 284.200012207031 284.200012207031 3860.94388545761 3860.94388545761 3860.94388545761 1 1 0 [14][M+1]- 21 1.52239898482215 0.456974714966023 0.727110647079507
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1321 M284T3876 284.200012207031 284.200012207031 284.200012207031 3875.64648590193 3875.64648590193 3875.64648590193 1 0 1 [13][M+1]- 55 2.02727230040373 0.572022846500683 0.665733978068083
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1323 M284T3842 284.300018310547 284.300018310547 284.300018310547 3842.0543413178 3842.0543413178 3842.0543413178 1 1 0 1363 Inf -1 0.5
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1324 M284T3168 284.300018310547 284.300018310547 284.300018310547 3167.72365472768 3167.72365472768 3167.72365472768 1 1 0 768 Inf -1 0.5
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1325 M284T3530 284.300018310547 284.300018310547 284.300018310547 3529.86368185261 3529.86368185261 3529.86368185261 1 0 1 1948 Inf 1 0.5
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1326 M284T3793 284.300018310547 284.300018310547 284.300018310547 3793.33039716198 3793.33039716198 3793.33039716198 1 1 0 5518 Inf -1 0.5
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1327 M284T3976 284.399993896484 284.399993896484 284.399993896484 3976.03175698205 3976.03175698205 3976.03175698205 1 0 1 2012 Inf 1 0.5
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1328 M284T3279 284.399993896484 284.399993896484 284.399993896484 3278.66099664615 3278.66099664615 3278.66099664615 1 0 1 1215 11.705996246935 0.911254729015997 0.527773985108883
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1329 M285T3365 284.800018310547 284.800018310547 284.800018310547 3364.81012749423 3364.81012749423 3364.81012749423 1 0 1 4649 3.77971358933055 0.710967562789433 0.594349713995631
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1330 M285T3334 284.899993896484 284.899993896484 284.899993896484 3333.626949866 3333.626949866 3333.626949866 1 1 0 1095 Inf -1 0.5
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1331 M285T4201 284.899993896484 284.899993896484 284.899993896484 4200.69027150176 4200.69027150176 4200.69027150176 1 1 0 5695 8.07864933680422 -0.869580295001216 0.540827001129913
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1334 M285T2715 285.100006103516 285.100006103516 285.100006103516 2715.29135416332 2714.37923400909 2716.20347431755 2 1 1 [15][M+1]- 49 1.00739126901881 0.0266988066844573 0.981129484715207
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1335 M285T4128 285.100006103516 285.100006103516 285.100006103516 4128.45105340014 4128.45105340014 4128.45105340014 1 0 1 [M+Cl]- 250.133 [M-H]- 286.109 23 1.0537608728576 0.323197855800896 0.800955030031345
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1336 M285T3692 285.200012207031 285.200012207031 285.200012207031 3692.35365604578 3692.26549459042 3692.44181750114 2 1 1 [16][M+1]- 5 2.65573600897259 -0.882752889453686 0.53945837736364
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1337 M285T2761 285.200012207031 285.200012207031 285.200012207031 2760.57554950021 2760.57554950021 2760.57554950021 1 1 0 5488 Inf -2.29654066908439 0.261445741349186
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1339 M285T2776 285.200012207031 285.200012207031 285.200012207031 2776.14948313805 2776.14948313805 2776.14948313805 1 0 1 5120 Inf 1 0.5
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1340 M285T3397 285.200012207031 285.200012207031 285.200012207031 3397.48157498888 3397.48157498888 3397.48157498888 1 1 0 473 1.53143015330632 -0.885220256656695 0.500369549717336
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1341 M285T2803 285.200012207031 285.200012207031 285.200012207031 2802.63101261762 2802.63101261762 2802.63101261762 1 0 1 5181 Inf 1 0.5
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1342 M285T2539 285.200012207031 285.200012207031 285.200012207031 2538.69097459635 2538.69097459635 2538.69097459635 1 1 0 184 3.71441537266418 -1.03137009426213 0.490105874113248
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1344 M285T4203 285.300018310547 285.300018310547 285.300018310547 4202.93110769693 4202.93110769693 4202.93110769693 1 0 1 5697 Inf 1 0.5
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1345 M286T3509 285.899993896484 285.899993896484 285.899993896484 3508.87518255866 3508.87518255866 3508.87518255866 1 0 1 4519 Inf 1 0.5
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1356 M286T3873 286.300018310547 286.300018310547 286.300018310547 3873.18822164528 3873.18822164528 3873.18822164528 1 1 0 2737 Inf -1 0.5
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1357 M286T3363 286.300018310547 286.300018310547 286.300018310547 3363.27027203292 3363.27027203292 3363.27027203292 1 0 1 4650 Inf 1 0.5
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1358 M286T3602 286.5 286.5 286.5 3601.50136519678 3601.50136519678 3601.50136519678 1 0 1 1445 Inf 1 0.5
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1359 M287T2666 286.899993896484 286.899993896484 286.899993896484 2666.35540765467 2666.35540765467 2666.35540765467 1 0 1 4039 5.64430505360168 0.810212592477565 0.559925803467312
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1362 M287T3102 287 287 287 3102.2333686911 3102.2333686911 3102.2333686911 1 1 0 3130 Inf -1 0.5
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1364 M287T3197 287 287 287 3197.37151623259 3197.37151623259 3197.37151623259 1 1 0 1749 Inf -1 0.5
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1365 M287T3315 287 287 287 3314.72886796556 3314.72886796556 3314.72886796556 1 1 0 520 Inf -1 0.5
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1367 M287T3252 287.200012207031 287.200012207031 287.200012207031 3252.32314306707 3251.13198122451 3253.51430490962 2 1 1 [17][M+1]- 34 1.39728301817981 -1.08871803569469 0.39544505308796
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1368 M287T2688 287.200012207031 287.200012207031 287.200012207031 2687.58718990559 2687.58718990559 2687.58718990559 1 0 1 6 9.69002112227918 1.20010829322396 0.436494844981453
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1369 M287T4138 287.200012207031 287.200012207031 287.200012207031 4137.82080373509 4137.82080373509 4137.82080373509 1 1 0 99 2.17830472708827 0.723440200357266 0.548502199752901
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1371 M288T2649 287.899993896484 287.899993896484 287.899993896484 2648.81282919735 2648.81282919735 2648.81282919735 1 0 1 196 1.56795051988048 0.305399673415079 0.793349024414123
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1372 M288T4025 287.899993896484 287.899993896484 287.899993896484 4024.92890734219 4024.92890734219 4024.92890734219 1 1 0 [M+Cl]- 252.936 185 3.05789019692468 -0.827065378364872 0.527312204456329
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1373 M288T3545 287.899993896484 287.899993896484 287.899993896484 3545.20838166108 3545.20838166108 3545.20838166108 1 1 0 2337 Inf -1 0.5
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1374 M288T3580 287.899993896484 287.899993896484 287.899993896484 3580.24107129216 3580.24107129216 3580.24107129216 1 0 1 1656 Inf 1 0.5
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1375 M288T3785 287.899993896484 287.899993896484 287.899993896484 3785.3142850522 3785.3142850522 3785.3142850522 1 1 0 3667 1.16014728461096 -0.104558891363138 0.926450177511418
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1377 M288T3083 288 288 288 3083.31311213932 3083.31311213932 3083.31311213932 1 0 1 3522 3.11973858435556 0.647032979443383 0.61891431393948
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1378 M288T2772 288 288 288 2771.58271010779 2771.58271010779 2771.58271010779 1 1 0 5121 Inf -1 0.5
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1379 M288T3631 288 288 288 3631.09140232317 3631.09140232317 3631.09140232317 1 1 0 45 1.7665368757792 -0.377615710683273 0.750223410807738
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1380 M288T2795 288.100006103516 288.100006103516 288.100006103516 2795.42243917229 2793.16296782797 2795.42243917229 3 1 1 3935 2.79631579432957 1.01365082202227 0.495420875155602
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1381 M288T3468 288.100006103516 288.100006103516 288.100006103516 3468.29771029223 3468.29771029223 3468.29771029223 1 1 0 66 2.57914368305006 -0.847974323061284 0.499180159830587
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1382 M288T2785 288.200012207031 288.200012207031 288.200012207031 2785.14849429222 2785.14849429222 2785.14849429222 1 1 0 907 1.70952813828712 -0.453118072715168 0.69620049455399
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1383 M288T3833 288.300018310547 288.300018310547 288.300018310547 3833.1524465394 3833.1524465394 3833.1524465394 1 0 1 3351 19.650880133649 1.58708332922702 0.355358445890146
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1384 M288T3515 288.300018310547 288.300018310547 288.300018310547 3515.09745671683 3515.09745671683 3515.09745671683 1 0 1 389 Inf 1 0.5
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1385 M288T3539 288.300018310547 288.300018310547 288.300018310547 3538.57945160982 3538.57945160982 3538.57945160982 1 0 1 1932 Inf 3.2764729188542 0.188583517478814
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1386 M288T4142 288.300018310547 288.300018310547 288.300018310547 4142.41184997807 4142.41184997807 4142.41184997807 1 0 1 4212 Inf 1 0.5
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1387 M288T3356 288.399993896484 288.399993896484 288.399993896484 3355.56487489459 3355.56487489459 3355.56487489459 1 0 1 7 2.44974406060029 -1.35874991193196 0.366289860558583
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1388 M288T3376 288.399993896484 288.399993896484 288.399993896484 3375.58219226441 3375.58219226441 3375.58219226441 1 0 1 25 1.02734290700533 0.0190718567295134 0.986516502331323
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1389 M288T3427 288.399993896484 288.399993896484 288.399993896484 3427.45273613588 3427.45273613588 3427.45273613588 1 1 0 5258 Inf -1 0.5
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1390 M289T3410 288.899993896484 288.899993896484 288.899993896484 3409.98110689111 3409.98110689111 3409.98110689111 1 1 0 2546 Inf -1 0.5
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1391 M289T4138 288.899993896484 288.899993896484 288.899993896484 4137.84320879208 4137.84320879208 4137.84320879208 1 1 0 3966 1.15979365057182 -0.124269970997586 0.91281712757035
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1392 M289T2716 289 289 289 2715.55423187058 2715.55423187058 2715.55423187058 1 1 0 2455 2.58829016665294 -1.29515015324749 0.336363562519764
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1393 M289T3528 289 289 289 3527.59982288162 3527.59982288162 3527.59982288162 1 0 1 390 3.1245088960914 0.647591060577923 0.618690275098223
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1394 M289T3568 289 289 289 3567.90711566462 3567.90711566462 3567.90711566462 1 1 0 1640 11.9311140862861 -1.46680939036393 0.374788789213361
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1395 M289T2961 289 289 289 2961.0658245432 2961.0658245432 2961.0658245432 1 1 0 3251 Inf -1 0.5
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1396 M289T3247 289 289 289 3246.98505522734 3246.98505522734 3246.98505522734 1 1 0 3461 Inf -4.88647326664272 0.128507684311186
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lecorguille
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1397 M289T2705 289.100006103516 289.100006103516 289.100006103516 2704.74308944844 2704.74308944844 2704.74308944844 1 1 0 4862 1.15600141798108 -0.177639198848952 0.880720776003115
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1398 M289T3925 289.200012207031 289.200012207031 289.200012207031 3924.64564840734 3924.64564840734 3924.64564840734 1 1 0 2982 4.08334835697189 -0.733429610113161 0.586206269752663
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lecorguille
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1399 M289T3127 289.200012207031 289.200012207031 289.200012207031 3127.40464345301 3127.40464345301 3127.40464345301 1 1 0 5590 3.1264999627772 -1.41463905177834 0.294309878516305
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lecorguille
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1400 M289T3225 289.200012207031 289.200012207031 289.200012207031 3225.35993655237 3225.35993655237 3225.35993655237 1 1 0 4302 Inf -1 0.5
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1401 M289T2559 289.200012207031 289.200012207031 289.200012207031 2559.03497459635 2559.03497459635 2559.03497459635 1 1 0 3069 5.23086614173228 -1.99285253292669 0.222355038215455
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lecorguille
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1402 M289T3192 289.200012207031 289.200012207031 289.200012207031 3192.00991294654 3192.00991294654 3192.00991294654 1 1 0 1750 1.36349550517854 -0.45494808907904 0.709214117949125
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1403 M289T3043 289.200012207031 289.200012207031 289.200012207031 3042.93368221238 3042.93368221238 3042.93368221238 1 0 1 3210 Inf 1 0.5
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lecorguille
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1404 M289T3916 289.300018310547 289.300018310547 289.300018310547 3916.43624900756 3916.43624900756 3916.43624900756 1 0 1 5137 Inf 1 0.5
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1405 M289T3603 289.300018310547 289.300018310547 289.300018310547 3603.14336270008 3603.14336270008 3603.14336270008 1 0 1 1446 Inf 1 0.5
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1406 M290T3423 289.800018310547 289.800018310547 289.800018310547 3422.66379466877 3422.66379466877 3422.66379466877 1 1 0 862 Inf -1 0.5
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1407 M290T3672 289.899993896484 289.899993896484 289.899993896484 3672.00891284854 3672.00891284854 3672.00891284854 1 1 0 445 Inf -3.33475252599044 0.185472587513133
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1408 M290T3888 289.899993896484 289.899993896484 289.899993896484 3887.5493594461 3887.5493594461 3887.5493594461 1 0 1 2229 1.73028642133671 0.365422358376353 0.757286521486094
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1409 M290T3254 289.899993896484 289.899993896484 289.899993896484 3254.30721889237 3254.30721889237 3254.30721889237 1 0 1 1913 Inf 1 0.5
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1410 M290T2584 289.899993896484 289.899993896484 289.899993896484 2584.07397459635 2584.07397459635 2584.07397459635 1 1 0 5739 Inf -1 0.5
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1414 M290T3972 290 290 290 3971.88874413291 3971.88874413291 3971.88874413291 1 1 0 1991 1.77655981599928 -0.435782866346357 0.7376746565902
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1415 M290T3484 290.300018310547 290.300018310547 290.300018310547 3484.15058009239 3484.15058009239 3484.15058009239 1 0 1 1780 4.33321293294372 1.25402996426608 0.387459658469469
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1416 M290T2670 290.300018310547 290.300018310547 290.300018310547 2669.56255652557 2669.56255652557 2669.56255652557 1 0 1 4040 Inf 3.91136716843365 0.159348064964928
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1417 M290T3045 290.300018310547 290.300018310547 290.300018310547 3044.50069244491 3044.50069244491 3044.50069244491 1 0 1 141 Inf 1 0.5
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1418 M290T3920 290.399993896484 290.399993896484 290.399993896484 3919.97936634922 3919.97936634922 3919.97936634922 1 1 0 2983 Inf -1 0.5
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1419 M290T3993 290.399993896484 290.399993896484 290.399993896484 3992.54085125997 3992.54085125997 3992.54085125997 1 1 0 118 Inf -1 0.5
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1420 M290T3369 290.399993896484 290.399993896484 290.399993896484 3369.44828355629 3369.44828355629 3369.44828355629 1 1 0 206 Inf -1 0.5
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1421 M291T3207 290.700012207031 290.700012207031 290.700012207031 3206.76974414588 3206.76974414588 3206.76974414588 1 0 1 4303 Inf 12.2131556522665 0.0520097196357796
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1422 M291T3225 290.800018310547 290.800018310547 290.800018310547 3225.47294906713 3224.09849107306 3226.84740706121 2 1 1 4304 2.13278736691631 0.480894231486276 0.694236617063754
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1423 M291T3815 290.800018310547 290.800018310547 290.800018310547 3815.37285047158 3815.37285047158 3815.37285047158 1 1 0 2379 1.99838656984426 -0.446780363887949 0.711952648980777
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1424 M291T3700 290.899993896484 290.899993896484 290.899993896484 3700.09697733735 3700.09697733735 3700.09697733735 1 1 0 4188 Inf -1 0.5
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1425 M291T3249 290.899993896484 290.899993896484 290.899993896484 3248.80362625011 3248.80362625011 3248.80362625011 1 0 1 1904 1.80994598447113 0.391689617482139 0.742186381077705
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1426 M291T3525 290.899993896484 290.899993896484 290.899993896484 3525.10461176924 3525.10461176924 3525.10461176924 1 1 0 391 3.04244465719919 -0.744793163996118 0.591999964027855
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1427 M291T4096 290.899993896484 290.899993896484 290.899993896484 4095.52908489535 4095.52908489535 4095.52908489535 1 1 0 150 1.57829544370982 -0.543226123313022 0.667243466957988
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1428 M291T4118 290.899993896484 290.899993896484 290.899993896484 4117.59270567894 4117.59270567894 4117.59270567894 1 0 1 4551 4.41394669852092 1.13981415012702 0.427580170627704
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1429 M291T2674 290.899993896484 290.899993896484 290.899993896484 2674.38567396616 2674.38567396616 2674.38567396616 1 0 1 644 Inf 1 0.5
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1430 M291T3218 290.899993896484 290.899993896484 290.899993896484 3217.8565814958 3217.8565814958 3217.8565814958 1 0 1 4305 5.10680258814171 0.789194493429924 0.566909433652155
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1431 M291T3323 290.899993896484 290.899993896484 290.899993896484 3322.77149725563 3322.77149725563 3322.77149725563 1 0 1 1142 10.670499554035 2.20486668990452 0.251071898920241
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1432 M291T4016 290.899993896484 290.899993896484 290.899993896484 4016.3492449455 4016.3492449455 4016.3492449455 1 1 0 242 Inf -1 0.5
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1433 M291T3269 291 291 291 3269.21467689755 3269.21467689755 3269.21467689755 1 0 1 174 2.11536207119989 -3.6445843769698 0.169818572892121
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lecorguille
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1434 M291T3291 291 291 291 3291.26753919816 3291.26753919816 3291.26753919816 1 0 1 2105 3.03361143472768 0.636661112561124 0.623110711163519
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lecorguille
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1435 M291T3672 291.100006103516 291.100006103516 291.100006103516 3671.96247760421 3671.96247760421 3671.96247760421 2 0 1 [M+Cl]- 256.128 2 3.18276591307931 1.47353014812453 0.337934624892573
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lecorguille
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1436 M291T2983 291.100006103516 291.100006103516 291.100006103516 2982.95337277204 2982.95337277204 2982.95337277204 1 1 0 124 2.68796866485511 -0.911927102005357 0.528350743282906
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lecorguille
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1437 M291T3664 291.200012207031 291.200012207031 291.200012207031 3663.99199932066 3662.13195491507 3665.85204372625 2 1 1 2 2.64307310404059 -2.51251700958996 0.183056720602389
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lecorguille
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1438 M291T3488 291.200012207031 291.200012207031 291.200012207031 3488.34099543631 3488.34099543631 3488.34099543631 1 0 1 1781 2.36710367302098 1.09052328739752 0.396471109585416
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lecorguille
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1439 M291T2966 291.200012207031 291.200012207031 291.200012207031 2966.37191352751 2966.37191352751 2966.37191352751 1 1 0 3242 2.4231206198297 -0.542894582667815 0.664034978930915
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lecorguille
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1440 M291T3558 291.200012207031 291.200012207031 291.200012207031 3558.36394863969 3558.36394863969 3558.36394863969 1 1 0 1657 4.89777774380336 -0.779739170453442 0.570098359468596
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1441 M291T4116 291.300018310547 291.300018310547 291.300018310547 4115.90921963138 4115.90921963138 4115.90921963138 1 1 0 2278 Inf -2.04050755392207 0.290091996812726
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1442 M291T3739 291.300018310547 291.300018310547 291.300018310547 3738.98137982459 3738.98137982459 3738.98137982459 1 0 1 4710 Inf 1 0.5
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lecorguille
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1443 M291T3987 291.300018310547 291.300018310547 291.300018310547 3986.99967742483 3986.99967742483 3986.99967742483 1 0 1 4489 1.47065962729225 -0.385573871326434 0.740742763903737
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1444 M291T3782 291.300018310547 291.300018310547 291.300018310547 3781.72876897582 3781.72876897582 3781.72876897582 1 0 1 88 Inf 1 0.5
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lecorguille
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1445 M291T3233 291.399993896484 291.399993896484 291.399993896484 3233.11338616637 3233.11338616637 3233.11338616637 1 0 1 54 1.37049998325664 0.282872953444827 0.819860781315667
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lecorguille
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1446 M291T3349 291.399993896484 291.399993896484 291.399993896484 3349.29618456545 3349.29618456545 3349.29618456545 1 1 0 690 5.0616711007314 -2.94776716406811 0.193020078608857
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1447 M292T3247 291.800018310547 291.800018310547 291.800018310547 3247.23300850549 3247.23300850549 3247.23300850549 1 0 1 1905 Inf 1 0.5
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lecorguille
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1448 M292T3328 291.899993896484 291.899993896484 291.899993896484 3327.72543495697 3327.72543495697 3327.72543495697 1 0 1 1096 Inf 1 0.5
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lecorguille
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1449 M292T3610 291.899993896484 291.899993896484 291.899993896484 3610.05809548103 3610.05809548103 3610.05809548103 1 0 1 2577 3.02864099778619 0.636044935770616 0.623361978998928
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1450 M292T3400 291.899993896484 291.899993896484 291.899993896484 3400.21216836929 3400.21216836929 3400.21216836929 1 0 1 1313 3.00447134300325 0.63302029638593 0.624598610410098
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1451 M292T3861 292.100006103516 292.100006103516 292.100006103516 3860.94388545761 3860.94388545761 3860.94388545761 1 1 0 [M+Cl]- 257.127 21 1.64463919255746 0.870135405435632 0.47810428005185
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1452 M292T3774 292.100006103516 292.100006103516 292.100006103516 3773.80318790725 3773.80318790725 3773.80318790725 1 0 1 5853 4.22181541077578 0.926205874770316 0.50472091519748
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1453 M292T3481 292.300018310547 292.300018310547 292.300018310547 3480.81381249498 3480.81381249498 3480.81381249498 1 1 0 1782 1.48673463908345 -0.313898484097089 0.800157184542388
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1454 M292T3288 292.300018310547 292.300018310547 292.300018310547 3288.12146612935 3288.12146612935 3288.12146612935 1 1 0 2106 Inf -1 0.5
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lecorguille
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1455 M292T3329 292.300018310547 292.300018310547 292.300018310547 3328.90967134892 3328.90967134892 3328.90967134892 1 1 0 1085 3.06865637799091 -0.640950188348216 0.621367824212186
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1456 M292T4094 292.300018310547 292.300018310547 292.300018310547 4093.96103778435 4093.96103778435 4093.96103778435 1 1 0 5117 Inf -1 0.5
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lecorguille
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1457 M292T3828 292.300018310547 292.300018310547 292.300018310547 3828.43115159383 3828.43115159383 3828.43115159383 1 0 1 1875 6.20617708818919 0.928292299016743 0.515877384020364
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1458 M292T3446 292.300018310547 292.300018310547 292.300018310547 3445.99797618665 3445.99797618665 3445.99797618665 1 1 0 2924 7.23019376428636 -0.85356571750482 0.545904543022263
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1459 M292T4055 292.300018310547 292.300018310547 292.300018310547 4054.7467802274 4054.7467802274 4054.7467802274 1 1 0 3417 1.0161225267781 -0.0126190834655794 0.991147941396955
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1460 M292T3642 292.399993896484 292.399993896484 292.399993896484 3641.98261419017 3641.98261419017 3641.98261419017 1 1 0 1521 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1461 M292T3341 292.399993896484 292.399993896484 292.399993896484 3341.47361287755 3341.47361287755 3341.47361287755 1 1 0 179 14.498022167364 -1.68023677121351 0.337219116057967
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1462 M293T3165 292.700012207031 292.700012207031 292.700012207031 3164.51054221883 3164.51054221883 3164.51054221883 1 1 0 827 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1463 M293T4141 292.899993896484 292.899993896484 292.899993896484 4140.86019981259 4140.86019981259 4140.86019981259 1 0 1 4213 Inf 1 0.5
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lecorguille
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1464 M293T3177 292.899993896484 292.899993896484 292.899993896484 3176.61340744548 3176.61340744548 3176.61340744548 1 0 1 769 1.42021535722725 0.241926490693601 0.833615492215864
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1465 M293T3435 293 293 293 3434.85505938608 3434.85505938608 3434.85505938608 1 1 0 4887 1.0437291867089 0.0453899778379612 0.968475905768587
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1466 M293T4137 293.100006103516 293.100006103516 293.100006103516 4136.64576660025 4136.64576660025 4136.64576660025 1 0 1 3967 1.65971209568182 0.396115329351269 0.75918795180962
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1467 M293T2821 293.200012207031 293.200012207031 293.200012207031 2820.9693756722 2820.9693756722 2820.9693756722 1 1 0 3292 5.07699110427983 -0.787894778779643 0.567345959534956
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1468 M293T3021 293.200012207031 293.200012207031 293.200012207031 3020.57576582784 3020.57576582784 3020.57576582784 1 1 0 2139 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1469 M293T2730 293.200012207031 293.200012207031 293.200012207031 2729.94511150645 2729.94511150645 2729.94511150645 1 0 1 2471 Inf 1 0.5
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lecorguille
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1470 M293T4177 293.200012207031 293.200012207031 293.200012207031 4177.13473042771 4177.13473042771 4177.13473042771 1 1 0 [M+Cl]- 258.229 115 2.13767646561344 -0.482063673350206 0.693643124313964
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1471 M293T3916 293.300018310547 293.300018310547 293.300018310547 3916.30780579745 3916.30780579745 3916.30780579745 1 1 0 5138 1.9589488560614 -0.859049190561909 0.507854591974473
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1472 M293T3475 293.300018310547 293.300018310547 293.300018310547 3474.60922997909 3474.60922997909 3474.60922997909 1 1 0 1783 4.65632009954076 -1.5936318240358 0.296183765547949
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1473 M293T3484 293.399993896484 293.399993896484 293.399993896484 3483.74931848153 3483.74931848153 3483.74931848153 1 0 1 31 1.42039222094453 0.412977091573542 0.746959527449945
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1474 M293T3319 293.399993896484 293.399993896484 293.399993896484 3319.45772848755 3319.45772848755 3319.45772848755 1 1 0 1143 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1475 M294T3484 293.5 293.5 293.5 3484.13394333629 3484.13394333629 3484.13394333629 1 1 0 1784 3.26594183793808 -0.663408103178648 0.612413807626569
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1476 M294T3362 293.700012207031 293.700012207031 293.700012207031 3361.97989608152 3361.97989608152 3361.97989608152 1 1 0 4651 3.38728552943959 -0.675937687290923 0.607540017962314
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1477 M294T2681 293.899993896484 293.899993896484 293.899993896484 2680.84636101147 2680.84636101147 2680.84636101147 1 0 1 645 1.01417189589 -0.00995028841579595 0.992964416146762
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1478 M294T2788 293.899993896484 293.899993896484 293.899993896484 2788.02229392021 2788.02229392021 2788.02229392021 1 0 1 908 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1479 M294T2997 293.899993896484 293.899993896484 293.899993896484 2997.23949272726 2997.23949272726 2997.23949272726 1 0 1 1823 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1480 M294T3965 293.899993896484 293.899993896484 293.899993896484 3965.26695536726 3965.26695536726 3965.26695536726 1 1 0 2013 Inf -1 0.5
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lecorguille
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1481 M294T3186 293.899993896484 293.899993896484 293.899993896484 3185.96106903426 3185.96106903426 3185.96106903426 1 1 0 2174 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1482 M294T3412 293.899993896484 293.899993896484 293.899993896484 3411.55546030634 3411.55546030634 3411.55546030634 1 1 0 863 Inf -1 0.5
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lecorguille
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1483 M294T3934 293.899993896484 293.899993896484 293.899993896484 3933.98462211521 3933.98462211521 3933.98462211521 1 1 0 2984 4.20069592570678 -0.741230647169632 0.583431301022322
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1484 M294T4027 293.899993896484 293.899993896484 293.899993896484 4027.44796471548 4027.44796471548 4027.44796471548 1 1 0 3761 1.67662268718912 -0.503930393711551 0.664866321872288
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lecorguille
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1485 M294T4106 294 294 294 4106.32959394557 4106.32959394557 4106.32959394557 1 1 0 5644 4.17835219359277 -1.04889643523587 0.456474026775846
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lecorguille
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1486 M294T4053 294.200012207031 294.200012207031 294.200012207031 4052.77255254373 4052.77255254373 4052.77255254373 1 1 0 3418 3.61853806309279 -0.697500568825858 0.599347141757558
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1487 M294T2688 294.200012207031 294.200012207031 294.200012207031 2687.58194841108 2687.58194841108 2687.58194841108 1 1 0 646 2.22052259564527 -0.501178107357521 0.684072717496586
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1488 M294T3656 294.200012207031 294.200012207031 294.200012207031 3655.86595939429 3655.86595939429 3655.86595939429 1 0 1 47 1.18618250405405 -0.212877003525564 0.852427785334329
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lecorguille
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1489 M294T2611 294.200012207031 294.200012207031 294.200012207031 2610.97128676082 2610.97128676082 2610.97128676082 1 1 0 4002 2.92113910186182 -0.622218318504061 0.629059207324479
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1490 M294T3352 294.300018310547 294.300018310547 294.300018310547 3352.47916777515 3352.47916777515 3352.47916777515 1 0 1 720 2.37135377737781 0.959058902802073 0.438774674942696
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1491 M294T3516 294.300018310547 294.300018310547 294.300018310547 3515.66717457865 3515.66717457865 3515.66717457865 1 1 0 392 Inf -2.92149432988105 0.209951026983482
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lecorguille
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1492 M294T2793 294.300018310547 294.300018310547 294.300018310547 2793.16296782797 2793.16296782797 2793.16296782797 1 0 1 909 Inf 1 0.5
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1493 M294T3742 294.300018310547 294.300018310547 294.300018310547 3742.14109500301 3742.14109500301 3742.14109500301 1 0 1 1044 1.87225999067699 0.584217696832064 0.623522513553903
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1494 M295T3584 294.600006103516 294.600006103516 294.600006103516 3583.82222879977 3583.82222879977 3583.82222879977 1 1 0 1694 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1495 M295T4109 294.899993896484 294.899993896484 294.899993896484 4109.47606512796 4109.47606512796 4109.47606512796 1 1 0 2291 3.22442408672339 -0.658906841010654 0.614185715945156
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1496 M295T3145 294.899993896484 294.899993896484 294.899993896484 3144.8136772185 3144.8136772185 3144.8136772185 1 0 1 3032 2.93853681081674 0.951107643031031 0.464120087166894
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1497 M295T3932 294.899993896484 294.899993896484 294.899993896484 3931.70490083927 3931.70490083927 3931.70490083927 1 0 1 2985 2.27879715852565 0.559770176262693 0.674377417453641
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1498 M295T3805 294.899993896484 294.899993896484 294.899993896484 3804.56933111418 3804.56933111418 3804.56933111418 1 1 0 2827 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1499 M295T2562 294.899993896484 294.899993896484 294.899993896484 2561.59608488001 2561.59608488001 2561.59608488001 1 0 1 3070 Inf 1 0.5
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lecorguille
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1500 M295T2969 295 295 295 2968.87878896985 2968.87878896985 2968.87878896985 1 1 0 3233 2.57538742457661 -0.792612397196995 0.553371252093237
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1501 M295T3542 295 295 295 3542.48800928712 3542.48800928712 3542.48800928712 1 1 0 2327 12.4845857269558 -5.71450419838111 0.0477349614215439
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1502 M295T3585 295 295 295 3585.11750339809 3585.11750339809 3585.11750339809 1 0 1 1695 Inf 1 0.5
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lecorguille
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1503 M295T3647 295 295 295 3647.28398452603 3647.28398452603 3647.28398452603 1 1 0 1532 2.95689139415771 -0.656385377584727 0.627344698549716
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1504 M295T3839 295.100006103516 295.100006103516 295.100006103516 3839.45718629423 3839.45718629423 3839.45718629423 1 0 1 3156 4.19498514306739 1.17558787891037 0.436658465678386
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1505 M295T4100 295.200012207031 295.200012207031 295.200012207031 4100.38978490831 4100.38978490831 4100.38978490831 1 0 1 5810 1.39704111636546 0.288518592258479 0.801824132212966
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1506 M295T3112 295.200012207031 295.200012207031 295.200012207031 3112.43657530524 3112.43657530524 3112.43657530524 1 0 1 165 1.10119537818269 -0.101128964497375 0.93580465434066
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1507 M295T2936 295.200012207031 295.200012207031 295.200012207031 2935.76807270673 2935.76807270673 2935.76807270673 1 0 1 2803 1.4585866715695 0.259313125254561 0.822386838206083
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1508 M295T2703 295.200012207031 295.200012207031 295.200012207031 2703.19511579694 2703.19511579694 2703.19511579694 1 1 0 4863 3.69884943770503 -0.704358292762743 0.596791190374806
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1509 M295T2787 295.200012207031 295.200012207031 295.200012207031 2786.52273155776 2786.52273155776 2786.52273155776 1 0 1 910 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1510 M295T2765 295.200012207031 295.200012207031 295.200012207031 2765.28357059722 2765.28357059722 2765.28357059722 1 1 0 3802 Inf -1.78770303695151 0.324684960355057
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lecorguille
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1511 M295T4039 295.200012207031 295.200012207031 295.200012207031 4039.05504542598 4039.05504542598 4039.05504542598 1 1 0 3762 14.6988439793749 -0.929818124340487 0.521997850089129
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1512 M295T4124 295.300018310547 295.300018310547 295.300018310547 4124.0320044962 4124.0320044962 4124.0320044962 1 0 1 1711 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1513 M295T3949 295.300018310547 295.300018310547 295.300018310547 3949.05152061741 3949.05152061741 3949.05152061741 1 0 1 3732 Inf 1 0.5
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lecorguille
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1514 M295T3571 295.300018310547 295.300018310547 295.300018310547 3570.97510000964 3570.97510000964 3570.97510000964 1 1 0 1658 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1515 M295T3993 295.300018310547 295.300018310547 295.300018310547 3993.20547644454 3993.20547644454 3993.20547644454 1 0 1 4490 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1516 M296T4069 295.899993896484 295.899993896484 295.899993896484 4068.86720908138 4068.86720908138 4068.86720908138 1 1 0 3873 1.13913906143303 0.133781364056394 0.912929361884156
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1517 M296T4108 295.899993896484 295.899993896484 295.899993896484 4108.07171749863 4108.07171749863 4108.07171749863 1 1 0 43 Inf -1 0.5
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lecorguille
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1518 M296T3870 295.899993896484 295.899993896484 295.899993896484 3870.04587697052 3870.04587697052 3870.04587697052 1 1 0 21 1.01461713432989 0.0102606123871581 0.99274501605709
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1519 M296T3307 295.899993896484 295.899993896484 295.899993896484 3307.00627849836 3307.00627849836 3307.00627849836 1 0 1 521 7.57449800788401 0.860511178711791 0.54369692072567
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1520 M296T4118 296 296 296 4117.59270567894 4117.59270567894 4117.59270567894 1 0 1 4552 1.92525600902925 2.96982990972961 0.184061032147853
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1521 M296T3811 296 296 296 3810.99738439489 3810.99738439489 3810.99738439489 1 1 0 2372 3.14314119120153 -0.794410076952748 0.565264214842044
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1522 M296T3954 296 296 296 3953.78264329169 3953.78264329169 3953.78264329169 1 0 1 5453 2.42560342811406 1.01863266048159 0.415585287016784
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1523 M296T2726 296.100006103516 296.100006103516 296.100006103516 2726.42611360523 2723.73277209484 2728.61065723844 4 2 2 2451 1.35425596719398 -1.68492275680916 0.235574249105523
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1524 M296T3681 296.200012207031 296.200012207031 296.200012207031 3681.31868571187 3681.31868571187 3681.31868571187 1 1 0 586 4.55330851379635 -1.16726347965777 0.420473548573923
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1525 M296T3561 296.200012207031 296.200012207031 296.200012207031 3560.56091424066 3560.56091424066 3560.56091424066 1 0 1 1659 1.58111683562622 0.908691421757939 0.530333288244769
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1526 M296T2848 296.200012207031 296.200012207031 296.200012207031 2848.21623475257 2848.21623475257 2848.21623475257 1 0 1 5628 1.88836029152553 0.694919173497526 0.56209832764863
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1527 M296T2785 296.200012207031 296.200012207031 296.200012207031 2785.03277491933 2785.03277491933 2785.03277491933 1 0 1 911 1.95457587739822 0.434780852047073 0.718368656945394
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1528 M296T3845 296.300018310547 296.300018310547 296.300018310547 3844.97719520822 3844.97719520822 3844.97719520822 1 0 1 1364 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1529 M296T3071 296.300018310547 296.300018310547 296.300018310547 3071.39529623095 3071.39529623095 3071.39529623095 1 1 0 2423 2.94468001743895 -0.625330062080118 0.627767110144055
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1530 M296T4075 296.300018310547 296.300018310547 296.300018310547 4075.14194222414 4075.14194222414 4075.14194222414 1 1 0 3874 9.12971504631063 -0.885173516496838 0.53592124463453
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1531 M296T3796 296.399993896484 296.399993896484 296.399993896484 3795.99336089506 3795.99336089506 3795.99336089506 1 0 1 123 Inf 1.92931674501127 0.304428107449571
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1532 M297T4128 296.899993896484 296.899993896484 296.899993896484 4128.44542811787 4128.44542811787 4128.44542811787 1 1 0 1479 Inf -1.28333527325553 0.421404670372306
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1533 M297T3313 296.899993896484 296.899993896484 296.899993896484 3313.1520157047 3313.1520157047 3313.1520157047 1 1 0 522 Inf -1.88009926019499 0.311199139194243
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1534 M297T3903 296.899993896484 296.899993896484 296.899993896484 3903.31811241095 3903.31811241095 3903.31811241095 1 0 1 4816 7.26910614891922 0.854384742469125 0.545643745508709
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1535 M297T3919 296.899993896484 296.899993896484 296.899993896484 3919.48040493361 3919.48040493361 3919.48040493361 1 1 0 2986 1.24861117665281 -0.155411435312373 0.891364343636558
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1536 M297T3385 296.899993896484 296.899993896484 296.899993896484 3384.81151443101 3384.81151443101 3384.81151443101 1 0 1 1551 2.14322908313692 0.988509292060595 0.448133122687799
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1537 M297T3813 297 297 297 3812.60482106373 3812.60482106373 3812.60482106373 1 1 0 2372 3.58968334919666 -0.860944761005056 0.546206293033093
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1538 M297T4180 297 297 297 4180.27602614419 4180.27602614419 4180.27602614419 1 1 0 5998 Inf -5.39943092927698 0.11658398001955
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1539 M297T2928 297.200012207031 297.200012207031 297.200012207031 2928.43329428729 2928.43329428729 2928.43329428729 1 0 1 3623 2.71953262922129 0.911914912429988 0.47344103834776
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1540 M297T3295 297.200012207031 297.200012207031 297.200012207031 3295.29181043493 3295.29181043493 3295.29181043493 1 0 1 2600 7.9748368141307 0.867809580586302 0.541386286533992
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1541 M297T3564 297.200012207031 297.200012207031 297.200012207031 3564.25588593458 3564.25588593458 3564.25588593458 1 0 1 1660 Inf 1.93499566791931 0.303664290592799
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1542 M297T3219 297.200012207031 297.200012207031 297.200012207031 3219.25981072202 3219.25981072202 3219.25981072202 1 1 0 4306 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1543 M297T3844 297.200012207031 297.200012207031 297.200012207031 3843.62618324498 3843.62618324498 3843.62618324498 1 1 0 [M-2H+Na]- 276.23 21 2.49199922571724 0.597512930113104 0.656479318124689
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1544 M297T4037 297.300018310547 297.300018310547 297.300018310547 4036.95286857231 4036.95286857231 4036.95286857231 1 1 0 3763 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1545 M297T3981 297.300018310547 297.300018310547 297.300018310547 3980.9703936919 3980.9703936919 3980.9703936919 1 1 0 5540 Inf -1 0.5
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lecorguille
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1546 M297T3389 297.300018310547 297.300018310547 297.300018310547 3389.42833570345 3389.42833570345 3389.42833570345 1 0 1 474 Inf 1.33506725767464 0.409268473725744
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1547 M298T3994 297.899993896484 297.899993896484 297.899993896484 3993.53112537303 3993.53112537303 3993.53112537303 1 1 0 4491 2.3228974941715 -0.523090659193013 0.673402762961895
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
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1548 M298T3021 298 298 298 3021.0020555035 3017.80278627848 3024.20132472852 2 0 2 2117 3.39617582048459 1.62240129868555 0.247030435255013
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1549 M298T3277 298 298 298 3276.71860604923 3276.71860604923 3276.71860604923 1 1 0 1237 1.35155392761763 0.209099140190732 0.855184700859225
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1550 M298T4132 298 298 298 4131.9151853691 4131.9151853691 4131.9151853691 1 0 1 1480 6.94844828564894 0.847352718349283 0.547887229142771
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1551 M298T4206 298 298 298 4206.08869342051 4206.08869342051 4206.08869342051 1 0 1 4924 Inf 1 0.5
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1552 M298T2983 298 298 298 2982.95337277204 2982.95337277204 2982.95337277204 1 1 0 124 7.61162873442281 -2.8552338105224 0.1494800831467
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1553 M298T3512 298.200012207031 298.200012207031 298.200012207031 3511.8571588571 3511.8571588571 3511.8571588571 1 1 0 119 3.30552507091674 -0.894504146712733 0.533806282479122
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1554 M298T2744 298.200012207031 298.200012207031 298.200012207031 2744.27300671808 2744.27300671808 2744.27300671808 1 1 0 122 6.09004895298932 -34.749613478431 0.00583552704496593
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1555 M298T3175 298.200012207031 298.200012207031 298.200012207031 3175.46440827929 3175.46440827929 3175.46440827929 1 1 0 753 9.33115320076215 -1.39132991012503 0.39635735563726
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
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1561 M298T3943 298.399993896484 298.399993896484 298.399993896484 3943.08690078556 3943.08690078556 3943.08690078556 1 0 1 4139 Inf 1 0.5
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1562 M298T3596 298.399993896484 298.399993896484 298.399993896484 3596.47394795055 3596.47394795055 3596.47394795055 1 1 0 22 Inf -7.00155242329752 0.0903147088294227
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1580 M300T4211 300.300018310547 300.300018310547 300.300018310547 4210.82391431008 4210.82391431008 4210.82391431008 1 0 1 4925 Inf 1 0.5
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1581 M300T3973 300.399993896484 300.399993896484 300.399993896484 3973.11882638474 3973.11882638474 3973.11882638474 1 1 0 1986 3.48382039752625 -0.685286243583767 0.603958366221947
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1582 M301T3897 300.899993896484 300.899993896484 300.899993896484 3897.01113119397 3897.01113119397 3897.01113119397 1 0 1 5752 Inf 1 0.5
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1583 M301T3937 300.899993896484 300.899993896484 300.899993896484 3936.93935391593 3936.93935391593 3936.93935391593 1 1 0 4140 Inf -1 0.5
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1584 M301T2928 300.899993896484 300.899993896484 300.899993896484 2928.01486524893 2928.01486524893 2928.01486524893 1 0 1 3624 Inf 1 0.5
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1585 M301T4014 300.899993896484 300.899993896484 300.899993896484 4013.70230738777 4013.70230738777 4013.70230738777 1 0 1 5210 Inf 2.22864023956923 0.268510767526041
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1586 M301T3826 300.899993896484 300.899993896484 300.899993896484 3826.36034427007 3826.36034427007 3826.36034427007 1 1 0 1876 Inf -1 0.5
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1604 M301T3451 301.300018310547 301.300018310547 301.300018310547 3451.29723481843 3451.29723481843 3451.29723481843 1 1 0 3331 Inf -1 0.5
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1605 M301T4110 301.399993896484 301.399993896484 301.399993896484 4109.63932175949 4109.63932175949 4109.63932175949 1 1 0 2292 Inf -1 0.5
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1617 M302T3670 302.200012207031 302.200012207031 302.200012207031 3670.468046418 3670.468046418 3670.468046418 1 1 0 [M+Cl]- 267.233 2 2.59646859925006 0.701157399753178 0.597492452815652
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1625 M302T3767 302.399993896484 302.399993896484 302.399993896484 3766.69939673832 3766.69939673832 3766.69939673832 1 1 0 952 4.61192101523005 -0.765384980562547 0.575000724217814
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1629 M303T3911 302.899993896484 302.899993896484 302.899993896484 3910.64900627845 3910.64900627845 3910.64900627845 1 1 0 4785 Inf -1.21056364159062 0.439542228065285
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1632 M303T3071 303 303 303 3071.23435236573 3071.23435236573 3071.23435236573 1 0 1 2424 4.75687160174225 0.772884250099439 0.572430020609768
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1639 M303T3630 303.300018310547 303.300018310547 303.300018310547 3630.45382566854 3630.45382566854 3630.45382566854 1 1 0 1608 Inf -1 0.5
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1640 M303T3199 303.399993896484 303.399993896484 303.399993896484 3198.84156835264 3198.84156835264 3198.84156835264 1 0 1 30 Inf 1 0.5
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1641 M304T3912 304 304 304 3911.73383581848 3911.73383581848 3911.73383581848 1 0 1 4817 Inf 1 0.5
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1642 M304T2668 304 304 304 2667.95814178929 2667.95814178929 2667.95814178929 1 0 1 4041 1.84835969245641 0.449643744041156 0.726317006613581
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1643 M304T2622 304 304 304 2621.82968780046 2621.82968780046 2621.82968780046 1 0 1 2642 1.34758292806733 0.20713031892447 0.856492664661453
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1646 M304T4288 304.200012207031 304.200012207031 304.200012207031 4287.64215089905 4287.64215089905 4287.64215089905 1 0 1 263 Inf 1 0.5
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1647 M304T2715 304.200012207031 304.200012207031 304.200012207031 2715.1745643195 2715.1745643195 2715.1745643195 1 0 1 2473 Inf 2.46722748345548 0.245148497951061
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1650 M304T3410 304.200012207031 304.200012207031 304.200012207031 3409.98110689111 3409.98110689111 3409.98110689111 1 1 0 50 4.57115889351838 -0.820638565236497 0.556151909557572
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1653 M304T3883 304.399993896484 304.399993896484 304.399993896484 3883.04786546855 3883.04786546855 3883.04786546855 1 1 0 2231 Inf -1 0.5
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1654 M305T4464 304.899993896484 304.899993896484 304.899993896484 4464.48215089905 4464.48215089905 4464.48215089905 1 0 1 338 Inf 1 0.5
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1655 M305T3304 305 305 305 3303.94373016607 3303.94373016607 3303.94373016607 1 1 0 5383 2.44203050603095 -0.546462359315894 0.662374920879189
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1656 M305T4086 305 305 305 4086.12110918763 4086.12110918763 4086.12110918763 1 1 0 4960 1.80741716950214 -0.445910574347346 0.732544417858088
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1658 M305T3343 305 305 305 3343.30928447979 3343.30928447979 3343.30928447979 1 1 0 803 Inf -1 0.5
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1659 M305T3451 305 305 305 3450.78005277903 3450.78005277903 3450.78005277903 1 1 0 3336 Inf -1 0.5
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1660 M305T3415 305 305 305 3415.08670310979 3415.08670310979 3415.08670310979 1 0 1 864 Inf 1 0.5
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1661 M305T3970 305 305 305 3969.55274519577 3969.55274519577 3969.55274519577 1 0 1 2014 7.74735626481719 0.981239521721324 0.505446924685043
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1664 M305T2998 305.100006103516 305.100006103516 305.100006103516 2998.10159411057 2997.37918354758 2998.82400467356 2 1 1 1826 1.37295149468048 3.1046188463694 0.196725565429064
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1665 M305T2712 305.100006103516 305.100006103516 305.100006103516 2711.57727406938 2711.57727406938 2711.57727406938 1 1 0 2449 2.43766721548506 -2.10588320123067 0.282235329767107
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1666 M305T3050 305.100006103516 305.100006103516 305.100006103516 3049.85437775332 3049.85437775332 3049.85437775332 1 1 0 3479 1.16958611316849 2.12550199076452 0.195633543441354
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1667 M305T2848 305.200012207031 305.200012207031 305.200012207031 2848.21623475257 2848.21623475257 2848.21623475257 1 0 1 5629 3.0890428409698 0.643401421223251 0.620376547994467
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1668 M305T3287 305.200012207031 305.200012207031 305.200012207031 3286.54221079343 3286.54221079343 3286.54221079343 1 0 1 3800 5.92444504827411 1.2275930101764 0.416506988359959
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1669 M305T2796 305.200012207031 305.200012207031 305.200012207031 2795.53226687069 2795.53226687069 2795.53226687069 1 0 1 3939 Inf 1 0.5
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1670 M305T2612 305.200012207031 305.200012207031 305.200012207031 2611.67508488001 2611.67508488001 2611.67508488001 1 0 1 4008 4.3151938757255 0.7484270737238 0.580894553486608
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1671 M305T3024 305.200012207031 305.200012207031 305.200012207031 3023.63722655074 3023.63722655074 3023.63722655074 1 1 0 2140 1.56041763262446 -0.302381029030035 0.795216864292192
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1672 M305T4111 305.300018310547 305.300018310547 305.300018310547 4111.42132545829 4111.42132545829 4111.42132545829 1 0 1 2293 Inf 1 0.5
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1673 M305T3975 305.300018310547 305.300018310547 305.300018310547 3975.06650309073 3975.06650309073 3975.06650309073 1 1 0 1983 3.553463371311 -1.6489019196083 0.244323630489917
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1674 M305T3402 305.300018310547 305.300018310547 305.300018310547 3401.7545455561 3401.7545455561 3401.7545455561 1 0 1 20 12.2752662661835 5.55765592264319 0.0505702451405385
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1675 M305T3918 305.399993896484 305.399993896484 305.399993896484 3917.89401957649 3917.89401957649 3917.89401957649 1 1 0 2988 Inf -1 0.5
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1676 M305T3397 305.399993896484 305.399993896484 305.399993896484 3397.18777341772 3397.18777341772 3397.18777341772 1 1 0 475 2.69241730032314 -0.589255825213219 0.643109158250097
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1677 M305T3374 305.399993896484 305.399993896484 305.399993896484 3374.07088695545 3374.07088695545 3374.07088695545 1 1 0 1553 4.23332363395108 -0.743321682399938 0.582691950955641
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1678 M306T3387 305.700012207031 305.700012207031 305.700012207031 3386.50166863204 3383.30760173397 3389.69573553011 2 1 1 1554 2.14379293816898 0.483520008137321 0.692905317020641
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1679 M306T3737 305.899993896484 305.899993896484 305.899993896484 3737.40215453346 3737.40215453346 3737.40215453346 1 0 1 155 Inf 1 0.5
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1680 M306T3583 305.899993896484 305.899993896484 305.899993896484 3583.48899555608 3583.48899555608 3583.48899555608 1 0 1 1696 Inf 1 0.5
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1683 M306T3500 306.100006103516 306.100006103516 306.100006103516 3499.5907337547 3498.32889314628 3502.11662938801 5 2 2 [21][M+1]- 76 1.41067037881914 1.12217567752376 0.390138538646588
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1685 M306T2638 306.100006103516 306.100006103516 306.100006103516 2637.61056956166 2637.61056956166 2637.61056956166 1 1 0 2622 1.73505828116507 -0.588408305384388 0.66095795854787
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lecorguille
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1686 M306T2927 306.100006103516 306.100006103516 306.100006103516 2926.78638974879 2926.78638974879 2926.78638974879 1 1 0 [22][M+1]- 60 1.01389415678183 -0.027236709084088 0.981087783824466
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1688 M306T2980 306.200012207031 306.200012207031 306.200012207031 2979.82441006508 2979.82441006508 2979.82441006508 1 1 0 5282 Inf -1 0.5
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1689 M306T3308 306.300018310547 306.300018310547 306.300018310547 3308.41925454435 3308.41925454435 3308.41925454435 1 1 0 523 Inf -1 0.5
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1690 M306T3952 306.300018310547 306.300018310547 306.300018310547 3952.2056060163 3952.2056060163 3952.2056060163 1 0 1 5454 4.73501464652693 1.14157457072291 0.431774715018596
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1691 M306T3891 306.300018310547 306.300018310547 306.300018310547 3891.34438369106 3891.34438369106 3891.34438369106 1 0 1 138 1.96888037072285 0.470312685596002 0.709867378189544
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1692 M306T3479 306.300018310547 306.300018310547 306.300018310547 3479.15909272518 3479.15909272518 3479.15909272518 1 0 1 1785 4.39293813265077 0.75309597811295 0.579260312070825
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1693 M306T3456 306.300018310547 306.300018310547 306.300018310547 3455.56264424004 3455.56264424004 3455.56264424004 1 1 0 1269 Inf -1 0.5
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1694 M307T3918 306.800018310547 306.800018310547 306.800018310547 3917.89401957649 3917.89401957649 3917.89401957649 1 1 0 2989 Inf -1 0.5
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1695 M307T3322 306.899993896484 306.899993896484 306.899993896484 3321.54953250363 3321.54953250363 3321.54953250363 1 0 1 1144 Inf 5.35619020585518 0.11750401783997
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1696 M307T3531 306.899993896484 306.899993896484 306.899993896484 3531.41514892439 3531.41514892439 3531.41514892439 1 0 1 1950 Inf 1 0.5
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1697 M307T2606 306.899993896484 306.899993896484 306.899993896484 2605.98397459635 2605.98397459635 2605.98397459635 1 1 0 4009 2.2107280573708 -1.21072487097655 0.439498987040802
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1698 M307T2785 306.899993896484 306.899993896484 306.899993896484 2785.35626528247 2785.35626528247 2785.35626528247 1 0 1 897 Inf 1 0.5
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1699 M307T2620 307 307 307 2620.06797459635 2619.50008488001 2620.4002803902 3 2 1 [23][M]- 53 1.17482292374467 -0.541905087988168 0.64323087283746
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1700 M307T3856 307 307 307 3856.01374663275 3856.01374663275 3856.01374663275 1 0 1 21 1.75297791405038 -0.648387417531104 0.596342863321928
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1701 M307T4039 307 307 307 4039.05504542598 4039.05504542598 4039.05504542598 1 1 0 92 4.09973309060554 -1.7067975776929 0.336592387078932
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1702 M307T3141 307.100006103516 307.100006103516 307.100006103516 3140.77338412856 3139.91402868484 3141.63273957229 2 1 1 [24][M]- 67 7.71807442578199 -0.965020596501004 0.511157964032511
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1703 M307T2856 307.100006103516 307.100006103516 307.100006103516 2856.47332793995 2856.47332793995 2856.47332793995 1 1 0 111 7.99065450941417 -0.955627381014863 0.513340887389908
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1704 M307T3292 307.200012207031 307.200012207031 307.200012207031 3292.19880652399 3292.19880652399 3292.19880652399 1 0 1 5761 1.90881226126106 0.475857246002785 0.717111101480569
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1705 M307T2775 307.200012207031 307.200012207031 307.200012207031 2774.74237044577 2774.74237044577 2774.74237044577 1 1 0 5122 3.09825382827592 -0.644498567254362 0.619933986850563
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1706 M307T3656 307.300018310547 307.300018310547 307.300018310547 3655.86595939429 3655.86595939429 3655.86595939429 1 0 1 47 Inf 1 0.5
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1707 M307T4091 307.300018310547 307.300018310547 307.300018310547 4090.59882489018 4090.59882489018 4090.59882489018 1 1 0 4972 Inf -1.40315564130998 0.394185401121918
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1708 M307T3981 307.300018310547 307.300018310547 307.300018310547 3980.9703936919 3980.9703936919 3980.9703936919 1 1 0 5541 Inf -1.34253918696219 0.407564992687777
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lecorguille
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1709 M307T3986 307.399993896484 307.399993896484 307.399993896484 3986.1874289802 3986.1874289802 3986.1874289802 1 1 0 4492 Inf -1 0.5
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lecorguille
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1710 M308T3902 307.800018310547 307.800018310547 307.800018310547 3901.74211364139 3901.74211364139 3901.74211364139 1 0 1 4818 Inf 1 0.5
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lecorguille
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1711 M308T3090 308 308 308 3089.60213809367 3089.60213809367 3089.60213809367 1 1 0 5361 1.93232484411089 -0.428507736033071 0.721760703217032
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lecorguille
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1712 M308T2622 308 308 308 2621.66108817722 2621.66108817722 2621.66108817722 1 1 0 [23][M+1]- 53 1.18870197808207 -1.19950555544667 0.378715031422453
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1713 M308T3611 308 308 308 3610.54864523817 3610.54864523817 3610.54864523817 1 1 0 2578 1.84177047027623 -0.401658224045918 0.736569688251484
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1714 M308T4186 308 308 308 4186.38103920383 4186.38103920383 4186.38103920383 1 1 0 6060 Inf -1.73034424998976 0.333605141246693
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1715 M308T3255 308.100006103516 308.100006103516 308.100006103516 3255.08398772709 3254.33971258947 3256.43182590051 3 2 1 [M-H-C6H8O6]- 485.134 34 4.8707288215545 -1.05797956009285 0.480435209103312
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lecorguille
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1716 M308T2856 308.100006103516 308.100006103516 308.100006103516 2856.47332793995 2856.47332793995 2856.47332793995 1 1 0 111 3.2225386975613 -0.889084609922318 0.537048009137924
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lecorguille
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1717 M308T3138 308.100006103516 308.100006103516 308.100006103516 3138.35441665664 3138.35441665664 3138.35441665664 1 1 0 [24][M+1]- 67 6.10991694939565 -0.956511750098571 0.513622473013973
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lecorguille
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1718 M308T3492 308.200012207031 308.200012207031 308.200012207031 3491.65134086927 3491.65134086927 3491.65134086927 1 1 0 31 3.80964023633714 -0.993872742980029 0.498652165416103
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lecorguille
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1719 M308T2702 308.200012207031 308.200012207031 308.200012207031 2702.03925094829 2702.03925094829 2702.03925094829 1 0 1 4864 1.25624243371857 -1.17551451584198 0.44799048001446
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1720 M308T3842 308.200012207031 308.200012207031 308.200012207031 3842.0543413178 3842.0543413178 3842.0543413178 1 1 0 1341 1.41636744902832 -1.14955879586808 0.453055829306681
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lecorguille
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1721 M308T2741 308.300018310547 308.300018310547 308.300018310547 2740.77769757478 2740.77769757478 2740.77769757478 1 0 1 4429 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1722 M308T4072 308.300018310547 308.300018310547 308.300018310547 4072.00465689111 4072.00465689111 4072.00465689111 1 1 0 96 Inf -2.26243057410056 0.264950545943567
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lecorguille
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1723 M308T3348 308.300018310547 308.300018310547 308.300018310547 3347.7337449269 3347.7337449269 3347.7337449269 1 1 0 692 Inf -1 0.5
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1724 M308T3605 308.300018310547 308.300018310547 308.300018310547 3605.48048482271 3605.48048482271 3605.48048482271 1 0 1 1447 Inf 1 0.5
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1725 M308T4182 308.399993896484 308.399993896484 308.399993896484 4181.68550617079 4181.68550617079 4181.68550617079 1 1 0 5999 Inf -1.57144941981319 0.360787199888823
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1726 M309T3290 309 309 309 3289.6928096902 3289.6928096902 3289.6928096902 1 0 1 38 5.18372691797512 1.50421873528788 0.331477677795473
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1727 M309T3212 309 309 309 3211.66692889316 3211.66692889316 3211.66692889316 1 1 0 4307 3.79913407834533 -0.712512713058879 0.593781978466227
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1728 M309T2925 309.100006103516 309.100006103516 309.100006103516 2925.13849136 2922.13475048773 2927.67227045736 4 2 2 [25][M]- 60 1.03547064033728 -0.097879972606439 0.935926371535733
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1729 M309T3461 309.100006103516 309.100006103516 309.100006103516 3460.67099542738 3460.67099542738 3460.67099542738 1 1 0 [26][M]- 19 11.5837913125481 -1.02682053652803 0.491506901259326
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1730 M309T3253 309.100006103516 309.100006103516 309.100006103516 3253.26864743207 3253.26864743207 3253.26864743207 1 1 0 [M-H-H20]- 328.128 34 2.17503883656825 -0.989930385806725 0.496692837081529
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1731 M309T3666 309.200012207031 309.200012207031 309.200012207031 3665.51859680559 3662.13195491507 3670.38411120383 4 2 2 2 1.05097241711971 0.243009734428466 0.83425885278622
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1732 M309T3017 309.200012207031 309.200012207031 309.200012207031 3017.37909879696 3017.37909879696 3017.37909879696 1 1 0 2141 5.10051623236193 -0.788921719668455 0.56700100103119
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1733 M309T2891 309.200012207031 309.200012207031 309.200012207031 2890.66347406525 2890.66347406525 2890.66347406525 1 0 1 3822 3.78873347649291 0.711687194406405 0.59408515687457
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1734 M309T3733 309.300018310547 309.300018310547 309.300018310547 3732.66820646028 3732.66820646028 3732.66820646028 1 0 1 3554 Inf 1 0.5
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1735 M309T4180 309.300018310547 309.300018310547 309.300018310547 4180.12028828767 4180.12028828767 4180.12028828767 1 1 0 6000 Inf -2.13693960913559 0.278640713779368
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1736 M309T3985 309.300018310547 309.300018310547 309.300018310547 3985.32113567117 3985.32113567117 3985.32113567117 1 0 1 4493 5.81398894616767 1.04325277633252 0.486187673150036
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1737 M309T4149 309.399993896484 309.399993896484 309.399993896484 4148.61566113482 4148.61566113482 4148.61566113482 1 0 1 5614 Inf 1 0.5
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1738 M310T3461 310.100006103516 310.100006103516 310.100006103516 3460.67099542738 3460.67099542738 3460.67099542738 1 1 0 [26][M+1]- 19 6.75870664536104 -0.97259234380291 0.50699746872425
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1739 M310T4201 310.100006103516 310.100006103516 310.100006103516 4201.23104164114 4201.23104164114 4201.23104164114 1 0 1 5698 2.00117589378012 -0.580830497135768 0.625504496967713
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1740 M310T2926 310.100006103516 310.100006103516 310.100006103516 2926.13109329645 2926.13109329645 2926.13109329645 1 1 0 [25][M+1]- 60 1.07170104918781 -0.265980632038686 0.831225679097833
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1741 M310T3461 310.200012207031 310.200012207031 310.200012207031 3460.51060880691 3457.15654781979 3463.86466979403 2 1 1 1256 1.62638422073012 0.65153998432665 0.587206775006855
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lecorguille
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lecorguille
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lecorguille
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1862 M317T3709 317.300018310547 317.300018310547 317.300018310547 3709.21253492763 3709.21253492763 3709.21253492763 1 1 0 1173 Inf -1 0.5
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lecorguille
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1867 M317T3870 317.399993896484 317.399993896484 317.399993896484 3870.20363499278 3870.20363499278 3870.20363499278 1 0 1 1366 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1868 M318T3709 317.5 317.5 317.5 3709.45764983761 3709.45764983761 3709.45764983761 1 1 0 1174 Inf -1 0.5
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lecorguille
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1869 M318T3713 317.899993896484 317.899993896484 317.899993896484 3712.84413919545 3712.84413919545 3712.84413919545 1 0 1 1156 6.03048818246519 0.822938253765861 0.555761332278931
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lecorguille
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1870 M318T4062 317.899993896484 317.899993896484 317.899993896484 4062.24649038317 4062.24649038317 4062.24649038317 1 1 0 4691 Inf -1 0.5
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lecorguille
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1871 M318T2626 317.899993896484 317.899993896484 317.899993896484 2626.44323289338 2626.44323289338 2626.44323289338 1 1 0 2643 Inf -1 0.5
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lecorguille
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1872 M318T2802 317.899993896484 317.899993896484 317.899993896484 2802.23561260848 2802.23561260848 2802.23561260848 1 1 0 5182 Inf -1 0.5
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lecorguille
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1873 M318T3373 318 318 318 3372.53060628831 3372.53060628831 3372.53060628831 1 1 0 25 1.94911166386933 -0.806978707269716 0.517785840175909
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lecorguille
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1874 M318T3431 318 318 318 3430.6467692923 3430.6467692923 3430.6467692923 1 1 0 5260 Inf -1.37236144049679 0.400885984691284
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lecorguille
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1875 M318T3827 318 318 318 3827.07338085703 3827.07338085703 3827.07338085703 1 1 0 1879 1.95978065774632 -0.813426150334304 0.51050346519479
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lecorguille
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1876 M318T3631 318 318 318 3631.09140232317 3631.09140232317 3631.09140232317 1 1 0 2359 Inf -1 0.5
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lecorguille
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1877 M318T4118 318.100006103516 318.100006103516 318.100006103516 4117.72633782937 4117.72633782937 4117.72633782937 1 0 1 120 10.598306246956 0.901640626791527 0.530770943822171
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1878 M318T3248 318.100006103516 318.100006103516 318.100006103516 3247.90807073561 3247.90807073561 3247.90807073561 1 0 1 1901 1.66181349401154 1.47023757912121 0.313495349215852
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lecorguille
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1879 M318T2673 318.300018310547 318.300018310547 318.300018310547 2673.32420722935 2673.32420722935 2673.32420722935 1 0 1 4043 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1880 M318T3135 318.300018310547 318.300018310547 318.300018310547 3135.23149716279 3135.23149716279 3135.23149716279 1 1 0 4992 Inf -1 0.5
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lecorguille
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1881 M318T3975 318.300018310547 318.300018310547 318.300018310547 3975.06650309073 3975.06650309073 3975.06650309073 1 1 0 2017 1.77061216128651 -0.378961037523901 0.74944977192131
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1882 M318T3358 318.300018310547 318.300018310547 318.300018310547 3357.81958398463 3357.81958398463 3357.81958398463 1 0 1 721 14.409151109282 0.92836664861336 0.522449284760221
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1883 M318T4133 318.399993896484 318.399993896484 318.399993896484 4133.14561853743 4133.14561853743 4133.14561853743 1 1 0 1482 Inf -1 0.5
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lecorguille
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1884 M319T4094 318.899993896484 318.899993896484 318.899993896484 4093.74551053654 4093.74551053654 4093.74551053654 1 1 0 5093 Inf -1 0.5
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lecorguille
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1885 M319T4122 318.899993896484 318.899993896484 318.899993896484 4122.06642147928 4122.06642147928 4122.06642147928 1 1 0 1717 Inf -1.70118200176037 0.338312713486332
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lecorguille
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1886 M319T2873 319 319 319 2872.87612722882 2872.87612722882 2872.87612722882 1 1 0 133 2.42606611480025 -1.56078735405714 0.34760300678321
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lecorguille
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1887 M319T3697 319.100006103516 319.100006103516 319.100006103516 3696.54612966319 3696.54612966319 3696.54612966319 2 0 1 5482 1.76346326615648 0.867052721030678 0.543377439864806
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1888 M319T3699 319.200012207031 319.200012207031 319.200012207031 3698.53175380367 3698.53175380367 3698.53175380367 1 1 0 4188 1.7795965271187 -1.31103503802106 0.329545052398541
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1889 M319T2730 319.200012207031 319.200012207031 319.200012207031 2730.17055423377 2730.17055423377 2730.17055423377 1 1 0 2474 Inf -1 0.5
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lecorguille
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1890 M319T3312 319.300018310547 319.300018310547 319.300018310547 3311.73062117219 3311.73062117219 3311.73062117219 1 0 1 526 1.97941432826077 0.607840879395214 0.607954665077509
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1891 M319T3918 319.300018310547 319.300018310547 319.300018310547 3917.51138810985 3917.51138810985 3917.51138810985 1 0 1 2990 3.34203028616619 0.836325617556585 0.554388116079756
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1892 M319T3507 319.300018310547 319.300018310547 319.300018310547 3507.32334791108 3507.32334791108 3507.32334791108 1 0 1 3370 Inf 1.2635962042402 0.426197911103395
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1893 M319T3846 319.300018310547 319.300018310547 319.300018310547 3845.76161188123 3845.76161188123 3845.76161188123 1 0 1 1367 Inf 1.22549442667995 0.435714980533708
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1894 M319T3963 319.300018310547 319.300018310547 319.300018310547 3963.24477198361 3963.24477198361 3963.24477198361 1 0 1 1982 6.63325744703157 1.31455042250292 0.396836284011619
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1895 M319T3807 319.300018310547 319.300018310547 319.300018310547 3807.07951477301 3807.07951477301 3807.07951477301 1 0 1 3710 Inf 1 0.5
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lecorguille
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1896 M319T3937 319.399993896484 319.399993896484 319.399993896484 3936.81565274677 3936.81565274677 3936.81565274677 1 0 1 4142 Inf 1 0.5
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lecorguille
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1897 M319T3725 319.399993896484 319.399993896484 319.399993896484 3725.35499157089 3725.35499157089 3725.35499157089 1 0 1 128 6.22938507958114 0.82885871534891 0.553838690545124
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lecorguille
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1898 M320T2579 319.899993896484 319.899993896484 319.899993896484 2579.37897459635 2579.37897459635 2579.37897459635 1 1 0 4074 Inf -1 0.5
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lecorguille
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1899 M320T4059 319.899993896484 319.899993896484 319.899993896484 4058.65996267593 4058.65996267593 4058.65996267593 1 0 1 4692 Inf 1 0.5
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lecorguille
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1900 M320T2692 320 320 320 2692.34676200243 2692.34676200243 2692.34676200243 1 0 1 5871 2.11019468914499 0.66683585696957 0.578101106745563
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lecorguille
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1901 M320T4105 320 320 320 4105.11785797998 4105.11785797998 4105.11785797998 1 0 1 192 2.75527230563873 0.598838011395125 0.63895553994861
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1902 M320T3681 320 320 320 3681.42051469777 3681.42051469777 3681.42051469777 1 0 1 588 Inf 1 0.5
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lecorguille
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1903 M320T3254 320 320 320 3254.30721889237 3254.30721889237 3254.30721889237 1 0 1 1914 1.82919980419267 0.442053099544087 0.729458915169653
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1904 M320T3071 320 320 320 3071.23435236573 3071.23435236573 3071.23435236573 1 0 1 2426 2.93099440780229 1.06550781851135 0.412442544797458
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lecorguille
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1905 M320T3593 320 320 320 3593.21101663136 3593.21101663136 3593.21101663136 1 0 1 5884 2.01353347799381 0.544401836568847 0.649116291996291
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1906 M320T3412 320 320 320 3411.92082333921 3411.92082333921 3411.92082333921 1 0 1 865 6.50283186428711 1.08900450625253 0.461978600578496
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lecorguille
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1907 M320T3115 320.200012207031 320.200012207031 320.200012207031 3114.71953984805 3114.71953984805 3114.71953984805 1 0 1 243 1.2544149920758 0.387354656995034 0.758165783116405
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1908 M320T2526 320.200012207031 320.200012207031 320.200012207031 2526.317668269 2526.317668269 2526.317668269 1 0 1 5956 Inf 1.44864479315264 0.384637022086531
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1909 M320T3329 320.300018310547 320.300018310547 320.300018310547 3329.19115488308 3329.19115488308 3329.19115488308 1 1 0 1098 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1910 M320T3678 320.300018310547 320.300018310547 320.300018310547 3677.76126309236 3677.76126309236 3677.76126309236 1 0 1 3690 1.06784424823483 -0.0650862493490309 0.957400521366351
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1911 M320T3021 320.300018310547 320.300018310547 320.300018310547 3020.95606865409 3020.95606865409 3020.95606865409 1 0 1 2132 Inf 1.71937514734386 0.335361854475874
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1912 M320T3299 320.300018310547 320.300018310547 320.300018310547 3299.20289839133 3299.20289839133 3299.20289839133 1 1 0 2601 Inf -1 0.5
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lecorguille
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1913 M320T3967 320.300018310547 320.300018310547 320.300018310547 3967.12299579339 3967.12299579339 3967.12299579339 1 1 0 2018 6.49246468389738 -0.836115581947818 0.551493981700762
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1914 M320T3428 320.300018310547 320.300018310547 320.300018310547 3427.72141453625 3427.72141453625 3427.72141453625 1 0 1 158 12.0423566933309 0.913814502992756 0.526976889423724
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1915 M320T3733 320.399993896484 320.399993896484 320.399993896484 3732.66820646028 3732.66820646028 3732.66820646028 1 0 1 3556 Inf 1 0.5
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lecorguille
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1916 M321T3368 320.899993896484 320.899993896484 320.899993896484 3368.15395016139 3368.15395016139 3368.15395016139 1 1 0 4653 Inf -1 0.5
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lecorguille
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1917 M321T3254 320.899993896484 320.899993896484 320.899993896484 3254.33971258947 3254.33971258947 3254.33971258947 1 1 0 1915 Inf -1 0.5
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lecorguille
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1918 M321T3161 320.899993896484 320.899993896484 320.899993896484 3161.24066965383 3161.24066965383 3161.24066965383 1 0 1 828 Inf 1 0.5
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lecorguille
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1919 M321T3297 321 321 321 3296.8379418699 3296.8379418699 3296.8379418699 1 0 1 2596 5.13207353940883 1.07989769162856 0.47515672250338
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1920 M321T4136 321 321 321 4136.24529906271 4136.24529906271 4136.24529906271 1 1 0 [M-H]- 322.011 99 3.95178165739952 -1.0933687557404 0.43542383106396
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lecorguille
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1921 M321T3882 321 321 321 3881.92802874077 3881.92802874077 3881.92802874077 1 0 1 2217 23.6676165814151 1.48907525020958 0.374991481970619
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1922 M321T3275 321 321 321 3274.99853643994 3274.99853643994 3274.99853643994 1 0 1 145 Inf 1.43021303186797 0.388456806235051
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lecorguille
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1923 M321T3243 321 321 321 3243.1379945268 3243.1379945268 3243.1379945268 1 1 0 3464 6.97920156529535 -1.79698944734377 0.290912263993951
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lecorguille
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1924 M321T3657 321.100006103516 321.100006103516 321.100006103516 3656.97666799129 3649.75436085664 3673.09339025272 4 2 1 47 2.64370117720962 -1.12772820323572 0.46081215127112
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lecorguille
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1925 M321T3663 321.200012207031 321.200012207031 321.200012207031 3663.09775803079 3662.13195491507 3664.0635611465 2 0 2 2 2.48779620313187 0.772837760417395 0.574777528009765
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1926 M321T3277 321.200012207031 321.200012207031 321.200012207031 3277.08420686365 3277.08420686365 3277.08420686365 1 0 1 1212 Inf 1 0.5
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1927 M321T2680 321.200012207031 321.200012207031 321.200012207031 2679.65826374615 2679.65826374615 2679.65826374615 1 0 1 632 11.4904268784362 2.91310241662944 0.181028527584546
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1928 M321T2564 321.200012207031 321.200012207031 321.200012207031 2563.876668269 2563.876668269 2563.876668269 1 0 1 3071 Inf 1 0.5
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1929 M321T3038 321.200012207031 321.200012207031 321.200012207031 3038.23244317119 3038.23244317119 3038.23244317119 1 0 1 3211 Inf 1 0.5
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1930 M321T2815 321.200012207031 321.200012207031 321.200012207031 2814.56195796808 2814.56195796808 2814.56195796808 1 1 0 3293 Inf -1 0.5
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1931 M321T2994 321.200012207031 321.200012207031 321.200012207031 2994.28256299347 2994.28256299347 2994.28256299347 1 1 0 1834 3.00147793018104 -0.802070952617916 0.537999255693017
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
1932 M321T3239 321.200012207031 321.200012207031 321.200012207031 3239.38536416913 3239.38536416913 3239.38536416913 1 0 1 3465 Inf 1.53726575817387 0.367158088137614
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lecorguille
parents:
diff changeset
1933 M321T3609 321.300018310547 321.300018310547 321.300018310547 3609.2072731903 3609.2072731903 3609.2072731903 1 1 0 4677 7.91872429517928 -0.866832514679252 0.541695108354038
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
1934 M321T3988 321.300018310547 321.300018310547 321.300018310547 3987.77590186394 3987.77590186394 3987.77590186394 1 1 0 4480 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
1935 M321T3819 321.300018310547 321.300018310547 321.300018310547 3819.03452474863 3819.03452474863 3819.03452474863 1 1 0 1880 Inf -1.54420937541535 0.365847886312577
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
1936 M321T4055 321.399993896484 321.399993896484 321.399993896484 4054.7467802274 4054.7467802274 4054.7467802274 1 1 0 3420 Inf -1.65693970760669 0.345687957965089
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
1937 M322T4062 321.899993896484 321.899993896484 321.899993896484 4062.24649038317 4062.24649038317 4062.24649038317 1 1 0 4693 3.02802534737804 -0.635968477094951 0.623393173216315
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
1938 M322T3978 321.899993896484 321.899993896484 321.899993896484 3977.82980682972 3977.82980682972 3977.82980682972 1 1 0 2019 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
1939 M322T3946 322 322 322 3945.57253000368 3940.2186903424 3950.92636966496 2 1 1 3734 1.64944358109052 -0.640959350186877 0.632691969326053
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
1940 M322T3685 322 322 322 3684.81215208906 3684.81215208906 3684.81215208906 1 1 0 [M-H-C3H2O3]- 409.007 5 12.5010487184559 -1.28807695870123 0.416284459626047
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
1941 M322T2686 322 322 322 2685.68075810517 2685.68075810517 2685.68075810517 1 0 1 648 3.16253411095756 0.651980500429768 0.616934346764279
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lecorguille
parents:
diff changeset
1942 M322T2904 322 322 322 2903.61601878994 2903.61601878994 2903.61601878994 1 1 0 3915 2.79326026383141 -0.604428829288202 0.636558541438409
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
1943 M322T3013 322 322 322 3012.68568999327 3012.68568999327 3012.68568999327 1 1 0 2080 11.2128163174629 -1.0280269276139 0.488469301955504
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
1944 M322T2950 322 322 322 2950.139046458 2950.139046458 2950.139046458 1 1 0 3176 Inf -1 0.5
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lecorguille
parents:
diff changeset
1945 M322T3504 322.100006103516 322.100006103516 322.100006103516 3503.64772709283 3501.13294578439 3505.62363008716 3 1 2 [28][M]- 76 2.98779357671176 1.56523511388958 0.260401598517167
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
1946 M322T3383 322.100006103516 322.100006103516 322.100006103516 3383.43547752955 3381.76815667381 3385.10279838529 2 2 0 [29][M]- 25 10.9520343672427 -6.27104931071043 0.0966879952886717
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
1947 M322T3669 322.100006103516 322.100006103516 322.100006103516 3668.80508470333 3668.80508470333 3668.80508470333 1 0 1 2 1.28229379042769 0.269751008854164 0.819902290540338
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
1948 M322T3991 322.100006103516 322.100006103516 322.100006103516 3990.95261859624 3990.95261859624 3990.95261859624 1 1 0 4477 6.1982032091166 -2.13893824544324 0.218706735555553
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
1949 M322T3958 322.100006103516 322.100006103516 322.100006103516 3957.58957141938 3957.58957141938 3957.58957141938 1 1 0 5394 2.50439100077239 -0.557871993818665 0.65712223143983
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
1950 M322T3497 322.200012207031 322.200012207031 322.200012207031 3497.32009601279 3494.73645383791 3499.90373818767 2 2 0 [30][M]- [M-H-C5H8O4]- 455.237 76 2.20749076076799 -1.02088048835881 0.431131225016889
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
1951 M322T2646 322.200012207031 322.200012207031 322.200012207031 2646.06874587309 2646.06874587309 2646.06874587309 1 1 0 237 1.11312714631459 0.0845497805773143 0.940414323093292
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
1952 M322T3143 322.200012207031 322.200012207031 322.200012207031 3142.59911125088 3142.59911125088 3142.59911125088 1 1 0 3109 2.63087161129939 -0.619331309811041 0.646681410724554
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
1953 M322T4015 322.200012207031 322.200012207031 322.200012207031 4015.11576581835 4015.11576581835 4015.11576581835 1 0 1 6089 Inf 2.27462218452923 0.263687742596664
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
1954 M322T3447 322.300018310547 322.300018310547 322.300018310547 3446.56346688244 3446.56346688244 3446.56346688244 1 1 0 62 4.10281637309155 -2.81150252824413 0.154627008289278
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
1955 M322T3459 322.300018310547 322.300018310547 322.300018310547 3458.75015890217 3458.75015890217 3458.75015890217 1 1 0 1255 4.51810957280062 -2.06659587092274 0.280014173243942
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
1956 M322T3884 322.300018310547 322.300018310547 322.300018310547 3884.39550161646 3884.39550161646 3884.39550161646 1 0 1 2218 Inf 2.92561406965789 0.209676316358993
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
1957 M322T3153 322.300018310547 322.300018310547 322.300018310547 3152.76661790971 3152.76661790971 3152.76661790971 1 0 1 3033 1.60056538561176 0.318218152656887 0.78547328909107
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
1958 M322T3213 322.300018310547 322.300018310547 322.300018310547 3213.10641889902 3213.10641889902 3213.10641889902 1 0 1 4309 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
1959 M322T3814 322.300018310547 322.300018310547 322.300018310547 3813.80227691426 3813.80227691426 3813.80227691426 1 1 0 2381 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
1960 M322T3579 322.300018310547 322.300018310547 322.300018310547 3578.99754016693 3578.99754016693 3578.99754016693 1 1 0 27 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
1961 M323T2617 322.899993896484 322.899993896484 322.899993896484 2617.23128676082 2617.23128676082 2617.23128676082 1 1 0 191 3.37348925424942 -0.843488497403395 0.527124059037806
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
1962 M323T3155 322.899993896484 322.899993896484 322.899993896484 3154.99597263236 3154.99597263236 3154.99597263236 1 0 1 5904 4.61454003950747 0.765524753865163 0.574952616114262
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
1963 M323T3907 322.899993896484 322.899993896484 322.899993896484 3906.7944394378 3906.7944394378 3906.7944394378 1 1 0 4820 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
1964 M323T3359 322.899993896484 322.899993896484 322.899993896484 3358.63038226179 3358.63038226179 3358.63038226179 1 1 0 689 Inf -1.31195020724259 0.414616902494799
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
1965 M323T4009 323 323 323 4009.23164498528 4009.23164498528 4009.23164498528 1 1 0 5212 Inf -5.40227260811192 0.116524015915129
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lecorguille
parents:
diff changeset
1966 M323T3503 323.100006103516 323.100006103516 323.100006103516 3503.37828793577 3494.46617918035 3506.21154706686 4 2 2 [28][M+1]- 76 1.50602667263756 0.451341239867068 0.709070685557077
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
1967 M323T3380 323.100006103516 323.100006103516 323.100006103516 3379.58373842578 3378.68960817281 3380.47786867874 2 2 0 [29][M+1]- 25 21.8824417988845 -4.85805973186156 0.128813449711511
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
1968 M323T3871 323.100006103516 323.100006103516 323.100006103516 3870.9333257166 3870.9333257166 3870.9333257166 1 0 1 2727 14.1615938824755 0.938567923424233 0.520113748456218
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
1969 M323T3500 323.200012207031 323.200012207031 323.200012207031 3499.90373818767 3494.73645383791 3503.64772709283 3 2 1 [30][M+1]- 76 1.50575052284746 0.350114571782354 0.785584939747311
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
1970 M323T4081 323.200012207031 323.200012207031 323.200012207031 4081.47888012129 4081.47888012129 4081.47888012129 1 0 1 5712 2.0085996567628 1.03463808539628 0.418947462090965
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
1971 M323T3139 323.200012207031 323.200012207031 323.200012207031 3139.30178915582 3139.30178915582 3139.30178915582 1 0 1 [M+Cl+NH3]- 271.206 [M+Cl]- 288.233 67 6.41205562334667 1.46068852885797 0.358018987239049
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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1972 M323T2850 323.200012207031 323.200012207031 323.200012207031 2850.24757333891 2850.24757333891 2850.24757333891 1 1 0 208 3.36824558660495 -0.674030907839591 0.608276243987133
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
1973 M323T3887 323.200012207031 323.200012207031 323.200012207031 3886.63638622928 3886.63638622928 3886.63638622928 1 0 1 41 16.8524471059379 1.03427608515106 0.488740495605784
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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1974 M323T3387 323.200012207031 323.200012207031 323.200012207031 3386.6458896204 3386.6458896204 3386.6458896204 1 1 0 476 3.00573708145849 -8.54308320901656 0.0238766091990201
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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1975 M323T3211 323.200012207031 323.200012207031 323.200012207031 3211.49389160157 3211.49389160157 3211.49389160157 1 1 0 4288 3.59997724276109 -1.6201001441739 0.252717716173422
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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1976 M323T3108 323.300018310547 323.300018310547 323.300018310547 3108.41931923499 3108.41931923499 3108.41931923499 1 1 0 3133 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
1977 M323T3910 323.300018310547 323.300018310547 323.300018310547 3909.62619158916 3909.62619158916 3909.62619158916 1 0 1 4797 1.30394209148312 -0.266065727120082 0.821131375612094
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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1978 M323T3351 323.300018310547 323.300018310547 323.300018310547 3351.12397404662 3351.12397404662 3351.12397404662 1 1 0 722 Inf -16.367142866784 0.0388479154060866
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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1979 M323T4059 323.399993896484 323.399993896484 323.399993896484 4059.45392694636 4059.45392694636 4059.45392694636 1 1 0 4694 10.1961066216841 -0.897616579786072 0.532027228977052
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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1980 M324T2708 323.899993896484 323.899993896484 323.899993896484 2708.49986163552 2706.96523737293 2710.03448589812 2 1 1 225 1.68793902285862 -0.412646744822045 0.722644012567428
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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1981 M324T2548 323.899993896484 323.899993896484 323.899993896484 2548.07997459635 2548.07997459635 2548.07997459635 1 1 0 5158 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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1982 M324T3403 323.899993896484 323.899993896484 323.899993896484 3403.38646124844 3403.38646124844 3403.38646124844 1 1 0 1315 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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1983 M324T3864 324 324 324 3864.0976243623 3864.0976243623 3864.0976243623 1 1 0 1368 10.0481268390278 -1.108371061818 0.463020571853759
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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1984 M324T2817 324 324 324 2816.76565493125 2816.76565493125 2816.76565493125 1 0 1 73 2.64797556284761 5.3402739598393 0.0343907213634833
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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1985 M324T3258 324 324 324 3258.22305440606 3258.22305440606 3258.22305440606 1 0 1 3614 Inf 2.43611220335314 0.247974064397839
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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1986 M324T3510 324 324 324 3510.42857745954 3510.42857745954 3510.42857745954 1 0 1 4522 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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1987 M324T2789 324.100006103516 324.100006103516 324.100006103516 2789.06120506784 2786.90521866559 2789.52257744508 3 1 2 [M-H-COCH2]- 367.108 12 1.56151614062788 4.41031019499159 0.0650457672040976
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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1988 M324T2751 324.100006103516 324.100006103516 324.100006103516 2751.27429914955 2750.03057836802 2752.51801993109 2 0 2 [M-H-COCH2]- 367.11 114 1.27381399060462 1.89217692604984 0.259018807275095
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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1989 M324T3275 324.100006103516 324.100006103516 324.100006103516 3275.27884850235 3273.83909095546 3276.71860604923 2 2 0 5007 5.96200794446534 -1.60358993745755 0.343710044556109
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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1990 M324T3843 324.100006103516 324.100006103516 324.100006103516 3843.40060985387 3843.40060985387 3843.40060985387 1 0 1 [M-H+NaCOOH]- 257.127 21 1.05779336949288 -0.073541674727155 0.951469497167445
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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1991 M324T2893 324.200012207031 324.200012207031 324.200012207031 2892.58722465327 2892.58722465327 2892.58722465327 1 1 0 3823 1.87765868482807 0.541580398657862 0.64506061494509
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1992 M324T2708 324.200012207031 324.200012207031 324.200012207031 2708.49212766891 2708.49212766891 2708.49212766891 1 1 0 5875 2.65503291330608 -2.56944741294469 0.167205735084865
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1993 M324T3301 324.200012207031 324.200012207031 324.200012207031 3301.47496649206 3301.47496649206 3301.47496649206 1 0 1 5384 1.83454820501519 -0.574443151288651 0.645259132145728
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1994 M324T2576 324.200012207031 324.200012207031 324.200012207031 2575.68108488001 2575.68108488001 2575.68108488001 1 0 1 4075 1.7828418230563 0.640063474340264 0.594071300863884
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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1995 M324T2831 324.200012207031 324.200012207031 324.200012207031 2830.85624517125 2830.85624517125 2830.85624517125 1 0 1 4576 5.24022292251157 0.794825382667996 0.565024723190476
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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1996 M324T4064 324.300018310547 324.300018310547 324.300018310547 4063.82406675099 4063.82406675099 4063.82406675099 1 1 0 5796 3.09177283027217 -0.643727265896385 0.620245038039623
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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1997 M324T3910 324.300018310547 324.300018310547 324.300018310547 3909.96477831024 3909.96477831024 3909.96477831024 1 1 0 4821 1.03198026535322 -0.0341369604838677 0.976661645945394
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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1998 M324T3362 324.300018310547 324.300018310547 324.300018310547 3361.727738288 3361.727738288 3361.727738288 1 1 0 4654 1.56858549055237 -0.382243211481115 0.739375976778521
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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1999 M324T3798 324.399993896484 324.399993896484 324.399993896484 3798.09149416646 3798.09149416646 3798.09149416646 1 1 0 2833 2.99968735544279 -0.63241598125901 0.624846330761927
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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2000 M325T4089 324.899993896484 324.899993896484 324.899993896484 4089.02533581174 4089.02533581174 4089.02533581174 1 1 0 4974 Inf -2.01902581695797 0.292763100813455
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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2001 M325T2876 324.899993896484 324.899993896484 324.899993896484 2875.6628607916 2875.6628607916 2875.6628607916 1 0 1 4728 Inf 1 0.5
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lecorguille
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2002 M325T3075 324.899993896484 324.899993896484 324.899993896484 3075.40739393198 3075.40739393198 3075.40739393198 1 1 0 2427 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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2003 M325T3316 325 325 325 3316.30541332026 3316.30541332026 3316.30541332026 1 1 0 527 2.02808883355332 -0.494812673734271 0.701424044687996
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lecorguille
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2004 M325T2642 325 325 325 2642.46037753233 2642.46037753233 2642.46037753233 1 0 1 195 1.89003373098508 0.972278874981195 0.438172611147724
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lecorguille
parents:
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2005 M325T2666 325.100006103516 325.100006103516 325.100006103516 2666.26302031591 2666.26302031591 2666.26302031591 1 1 0 103 8.99476423228041 -0.952270520531908 0.51551499384976
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lecorguille
parents:
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2006 M325T2609 325.200012207031 325.200012207031 325.200012207031 2608.54508488001 2608.54508488001 2608.54508488001 1 0 1 4010 10.3355756826812 1.76229315344671 0.315509973570407
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2007 M325T4135 325.200012207031 325.200012207031 325.200012207031 4134.66950325724 4134.66950325724 4134.66950325724 1 1 0 [M-H-C6H8O6]- 502.234 99 1.76013569376079 -0.416665580783048 0.741401546400863
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
2008 M325T3896 325.300018310547 325.300018310547 325.300018310547 3896.05117707473 3896.05117707473 3896.05117707473 1 0 1 4899 Inf 1.13734884644387 0.459146150339224
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
2009 M325T3866 325.300018310547 325.300018310547 325.300018310547 3865.67503918027 3865.67503918027 3865.67503918027 1 1 0 1369 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2010 M325T3430 325.300018310547 325.300018310547 325.300018310547 3430.09276063128 3430.09276063128 3430.09276063128 1 1 0 5261 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2011 M325T3708 325.399993896484 325.399993896484 325.399993896484 3707.90244866269 3707.90244866269 3707.90244866269 1 1 0 1175 3.05756049716838 -0.639602590783637 0.62191427390793
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2012 M325T3760 325.399993896484 325.399993896484 325.399993896484 3759.66571973942 3759.66571973942 3759.66571973942 1 0 1 13 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2013 M325T4066 325.399993896484 325.399993896484 325.399993896484 4066.41996987292 4066.41996987292 4066.41996987292 1 0 1 3875 Inf 1 0.5
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lecorguille
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2014 M325T3347 325.399993896484 325.399993896484 325.399993896484 3346.64812053373 3346.64812053373 3346.64812053373 1 0 1 804 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2015 M326T3705 325.5 325.5 325.5 3705.00880068764 3705.00880068764 3705.00880068764 1 0 1 17 Inf 1 0.5
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lecorguille
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2016 M326T4014 325.5 325.5 325.5 4013.94138185247 4013.94138185247 4013.94138185247 1 1 0 6090 Inf -1 0.5
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lecorguille
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2017 M326T3224 326 326 326 3224.18566217805 3224.18566217805 3224.18566217805 1 0 1 4310 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2018 M326T3211 326 326 326 3211.49389160157 3211.49389160157 3211.49389160157 1 1 0 113 4.94702673184027 -0.782040767920725 0.569319258615347
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2019 M326T3640 326 326 326 3640.39929305088 3640.39929305088 3640.39929305088 1 0 1 2852 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
2020 M326T4139 326.100006103516 326.100006103516 326.100006103516 4139.39602511555 4139.39602511555 4139.39602511555 1 1 0 [M-H-C3H2O3]- 413.107 4202 1.55120863439729 -0.34203485587917 0.783967291894033
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
2021 M326T3419 326.200012207031 326.200012207031 326.200012207031 3418.86257509538 3417.44952296517 3420.31704512667 4 2 2 [31][M]- [M-H]- 327.214 11 15.7722221272166 -10.6692845902109 0.0571473908790403
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
2022 M326T3305 326.300018310547 326.300018310547 326.300018310547 3304.60300140133 3300.52179370591 3308.68420909675 2 2 0 167 2.60229533012444 -1.58177685890761 0.259023814397102
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2023 M326T3068 326.300018310547 326.300018310547 326.300018310547 3067.69698928254 3067.69698928254 3067.69698928254 1 0 1 2415 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
2024 M326T3910 326.300018310547 326.300018310547 326.300018310547 3910.16592439504 3910.16592439504 3910.16592439504 1 0 1 4822 14.9608840257382 0.933125206449892 0.521996439815694
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2025 M326T2887 326.300018310547 326.300018310547 326.300018310547 2886.97775847116 2886.97775847116 2886.97775847116 1 0 1 5658 Inf 2.59417121473839 0.234229243671086
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2026 M326T3805 326.300018310547 326.300018310547 326.300018310547 3804.56933111418 3804.56933111418 3804.56933111418 1 1 0 58 1.63310338538577 -0.330611230278033 0.777946810026734
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2027 M326T4116 326.399993896484 326.399993896484 326.399993896484 4116.04284337128 4116.04284337128 4116.04284337128 1 0 1 4554 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2028 M327T2649 326.899993896484 326.899993896484 326.899993896484 2648.77356750916 2648.77356750916 2648.77356750916 1 1 0 5677 1.4691465306314 -0.391396657203473 0.734922734643153
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
2029 M327T3764 326.899993896484 326.899993896484 326.899993896484 3764.29623475206 3764.29623475206 3764.29623475206 1 0 1 973 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
2030 M327T2594 326.899993896484 326.899993896484 326.899993896484 2593.610668269 2593.610668269 2593.610668269 1 0 1 2887 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
2031 M327T3760 327 327 327 3760.43679228251 3760.43679228251 3760.43679228251 1 1 0 974 1.04036315195168 -0.110776822143304 0.923472435328889
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
2032 M327T3735 327 327 327 3735.48344916275 3735.48344916275 3735.48344916275 1 1 0 3557 Inf -1 0.5
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lecorguille
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2033 M327T3539 327 327 327 3539.18883199741 3539.18883199741 3539.18883199741 1 0 1 1951 Inf 1 0.5
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lecorguille
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2034 M327T3593 327 327 327 3593.36455864082 3593.36455864082 3593.36455864082 1 1 0 5885 Inf -15.0299644000357 0.0422943700364979
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2035 M327T2981 327 327 327 2981.3915398683 2981.3915398683 2981.3915398683 1 0 1 4624 1.07808598914776 -0.0662645328191311 0.954203827773305
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2036 M327T3820 327 327 327 3820.0833375965 3820.0833375965 3820.0833375965 1 1 0 1853 Inf -1.74685964258006 0.330991461720683
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2037 M327T3501 327.100006103516 327.100006103516 327.100006103516 3501.03172571717 3499.90373818767 3502.11662938801 4 2 2 [32][M]- 76 1.46194104945512 1.4647369910478 0.32653292064796
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2038 M327T3833 327.100006103516 327.100006103516 327.100006103516 3833.1524465394 3833.1524465394 3833.1524465394 1 0 1 75 1.1030789495086 -0.0826668694786645 0.942186088535277
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2039 M327T3418 327.200012207031 327.200012207031 327.200012207031 3418.47306972899 3415.87715861582 3421.06898084216 2 2 0 [31][M+1]- 11 22.752718185592 -14.5963857363274 0.0305136087175875
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2040 M327T3669 327.200012207031 327.200012207031 327.200012207031 3668.80508470333 3668.80508470333 3668.80508470333 1 0 1 [M+Cl+HCOOH]- 246.224 2 1.43108798973174 1.23383911481554 0.355249317207265
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lecorguille
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2041 M327T3258 327.200012207031 327.200012207031 327.200012207031 3258.22305440606 3258.22305440606 3258.22305440606 1 0 1 3600 Inf 2.44499407270372 0.247161220369897
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lecorguille
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2042 M327T3222 327.200012207031 327.200012207031 327.200012207031 3222.15019772111 3222.15019772111 3222.15019772111 1 0 1 4311 1.4864988810201 1.16686201347554 0.372334502808725
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2043 M327T3936 327.300018310547 327.300018310547 327.300018310547 3935.54239794017 3935.54239794017 3935.54239794017 1 1 0 4175 3.551928131607 0.819344933614431 0.541401603960079
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2044 M327T3809 327.300018310547 327.300018310547 327.300018310547 3809.08960940144 3809.08960940144 3809.08960940144 1 1 0 3711 Inf -1 0.5
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lecorguille
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2045 M327T3777 327.300018310547 327.300018310547 327.300018310547 3777.31229116986 3777.31229116986 3777.31229116986 1 1 0 3669 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2046 M327T4044 327.399993896484 327.399993896484 327.399993896484 4043.76321406946 4043.76321406946 4043.76321406946 1 1 0 4110 Inf -1 0.5
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lecorguille
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2047 M328T3969 327.899993896484 327.899993896484 327.899993896484 3968.71192623715 3968.71192623715 3968.71192623715 1 1 0 2020 Inf -1 0.5
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lecorguille
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2048 M328T3768 327.899993896484 327.899993896484 327.899993896484 3768.26520496847 3768.26520496847 3768.26520496847 1 1 0 975 Inf -1 0.5
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lecorguille
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2049 M328T3109 328 328 328 3109.26675111961 3109.26675111961 3109.26675111961 1 0 1 5343 Inf 1 0.5
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lecorguille
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2050 M328T3736 328 328 328 3736.28346343246 3736.28346343246 3736.28346343246 1 0 1 5197 Inf 1 0.5
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lecorguille
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2051 M328T3910 328 328 328 3909.62619158916 3909.62619158916 3909.62619158916 1 0 1 4823 Inf 1 0.5
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lecorguille
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2052 M328T3834 328 328 328 3834.20284641246 3834.20284641246 3834.20284641246 1 1 0 75 Inf -1 0.5
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lecorguille
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2053 M328T3343 328 328 328 3343.30928447979 3343.30928447979 3343.30928447979 1 1 0 805 2.13281498578569 -0.480900851140813 0.694233254999246
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lecorguille
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2054 M328T3367 328 328 328 3367.3903555858 3367.3903555858 3367.3903555858 1 0 1 126 Inf 1 0.5
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lecorguille
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2055 M328T2955 328 328 328 2954.82013041361 2954.82013041361 2954.82013041361 1 1 0 3183 1.08905251518989 -0.0602306564842917 0.957484167140911
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lecorguille
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2082 M330T2849 329.899993896484 329.899993896484 329.899993896484 2848.6929481257 2848.6929481257 2848.6929481257 1 1 0 5630 Inf -1 0.5
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2099 M330T4043 330.300018310547 330.300018310547 330.300018310547 4043.28357774511 4043.28357774511 4043.28357774511 1 1 0 5306 Inf -1 0.5
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2113 M331T3780 331.300018310547 331.300018310547 331.300018310547 3780.14359305867 3780.14359305867 3780.14359305867 1 0 1 3670 Inf 1 0.5
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2114 M331T3628 331.300018310547 331.300018310547 331.300018310547 3628.24021027642 3628.24021027642 3628.24021027642 1 0 1 1609 Inf 1 0.5
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2115 M331T4130 331.300018310547 331.300018310547 331.300018310547 4130.33844192957 4130.33844192957 4130.33844192957 1 0 1 1483 3.76119721045751 0.709479389825744 0.59489759927519
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2117 M332T3973 331.5 331.5 331.5 3973.11882638474 3973.11882638474 3973.11882638474 1 1 0 2022 Inf -1 0.5
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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2126 M332T3865 332.399993896484 332.399993896484 332.399993896484 3865.47422517578 3865.47422517578 3865.47422517578 1 0 1 1371 Inf 1 0.5
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lecorguille
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2127 M332T4232 332.399993896484 332.399993896484 332.399993896484 4231.77140158956 4231.77140158956 4231.77140158956 1 1 0 280 Inf -1 0.5
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lecorguille
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2128 M333T2704 332.899993896484 332.899993896484 332.899993896484 2703.7694318554 2703.68128100977 2703.85758270102 2 1 1 4865 1.07374964533284 0.0502625067149959 0.964501870455923
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lecorguille
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2129 M333T4080 332.899993896484 332.899993896484 332.899993896484 4079.903008509 4079.903008509 4079.903008509 1 0 1 5720 Inf 1 0.5
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lecorguille
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2130 M333T3355 332.899993896484 332.899993896484 332.899993896484 3354.62837029494 3354.62837029494 3354.62837029494 1 0 1 723 Inf 1 0.5
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lecorguille
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2131 M333T3521 333 333 333 3520.57714024828 3520.57714024828 3520.57714024828 1 0 1 368 1.24041475861008 0.389155773902489 0.735261366101299
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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2135 M333T2989 333.200012207031 333.200012207031 333.200012207031 2989.21254030496 2989.21254030496 2989.21254030496 1 1 0 4627 2.00820043778291 -0.449406209252775 0.710561380482463
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lecorguille
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2136 M333T2958 333.200012207031 333.200012207031 333.200012207031 2957.94240686028 2957.94240686028 2957.94240686028 1 1 0 3253 Inf -1 0.5
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lecorguille
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2137 M333T3744 333.300018310547 333.300018310547 333.300018310547 3744.08158908687 3744.08158908687 3744.08158908687 1 0 1 1036 Inf 1 0.5
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lecorguille
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2138 M333T3299 333.300018310547 333.300018310547 333.300018310547 3299.20289839133 3299.20289839133 3299.20289839133 1 1 0 2602 3.36750621940494 -0.702270663791838 0.609812552421879
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lecorguille
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2139 M333T3837 333.399993896484 333.399993896484 333.399993896484 3837.34147794623 3837.34147794623 3837.34147794623 1 1 0 3160 1.36354169262178 -0.21499505340416 0.851277184106987
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lecorguille
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2140 M333T4179 333.399993896484 333.399993896484 333.399993896484 4179.24904985862 4179.24904985862 4179.24904985862 1 0 1 4385 Inf 1 0.5
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lecorguille
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2141 M333T4007 333.399993896484 333.399993896484 333.399993896484 4007.31742726369 4007.31742726369 4007.31742726369 1 0 1 5213 1.29070992868265 -0.211097597468738 0.852418658931256
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lecorguille
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2142 M334T4135 333.800018310547 333.800018310547 333.800018310547 4135.06884588458 4135.06884588458 4135.06884588458 1 0 1 3971 Inf 1 0.5
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lecorguille
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2143 M334T3892 333.899993896484 333.899993896484 333.899993896484 3891.96202504143 3891.96202504143 3891.96202504143 1 1 0 138 Inf -1 0.5
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lecorguille
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2144 M334T3234 333.899993896484 333.899993896484 333.899993896484 3233.59458434886 3233.59458434886 3233.59458434886 1 1 0 2711 Inf -1 0.5
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lecorguille
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2145 M334T3547 333.899993896484 333.899993896484 333.899993896484 3546.98944553125 3546.98944553125 3546.98944553125 1 0 1 2338 Inf 1 0.5
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lecorguille
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2146 M334T3757 334 334 334 3756.58693534667 3756.58693534667 3756.58693534667 1 1 0 934 1.61581047281956 -0.460695643081137 0.702821780818713
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lecorguille
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2147 M334T3365 334 334 334 3364.81864344972 3364.81864344972 3364.81864344972 1 1 0 4648 2.12849554213712 -0.479863716916293 0.694760365160672
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lecorguille
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2148 M334T3238 334 334 334 3237.8168780028 3237.8168780028 3237.8168780028 1 0 1 54 5.87626178574201 0.818062798061864 0.557351531404832
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lecorguille
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2149 M334T3143 334 334 334 3143.2230045763 3143.2230045763 3143.2230045763 1 0 1 3109 2.56309118095894 2.92553033268563 0.111181028753271
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lecorguille
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2150 M334T3683 334 334 334 3682.87772773054 3682.87772773054 3682.87772773054 1 1 0 589 Inf -2.197354347366 0.271888188479555
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lecorguille
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2151 M334T3611 334 334 334 3611.3404101371 3611.3404101371 3611.3404101371 1 0 1 2580 3.2800950758381 0.6649168269458 0.611822408917278
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lecorguille
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lecorguille
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2153 M334T4147 334.100006103516 334.100006103516 334.100006103516 4147.24214461339 4147.24214461339 4147.24214461339 1 1 0 5625 2.23666201076627 -0.618738716879681 0.612456564213496
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lecorguille
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2154 M334T3005 334.100006103516 334.100006103516 334.100006103516 3004.86341197913 3004.86341197913 3004.86341197913 1 1 0 105 13.5942156147632 -0.99395202319642 0.501903638039589
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lecorguille
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2155 M334T3655 334.100006103516 334.100006103516 334.100006103516 3655.00472793762 3655.00472793762 3655.00472793762 1 1 0 [M+Cl]- 299.131 47 2.02573303718402 -1.37269818778704 0.339562427760111
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lecorguille
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2156 M334T4053 334.300018310547 334.300018310547 334.300018310547 4052.77255254373 4052.77255254373 4052.77255254373 1 1 0 3408 12.5687529834951 -1.39686035648016 0.390684438589726
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lecorguille
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2157 M334T3456 334.300018310547 334.300018310547 334.300018310547 3456.00219142961 3456.00219142961 3456.00219142961 1 1 0 1270 3.14038053637212 -0.649435904878343 0.617950937594278
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lecorguille
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lecorguille
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lecorguille
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2160 M334T3727 334.300018310547 334.300018310547 334.300018310547 3726.59997775795 3726.59997775795 3726.59997775795 1 1 0 3558 Inf -1 0.5
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lecorguille
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2161 M334T3516 334.399993896484 334.399993896484 334.399993896484 3515.66717457865 3515.66717457865 3515.66717457865 1 1 0 394 Inf -1 0.5
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lecorguille
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2162 M334T4099 334.399993896484 334.399993896484 334.399993896484 4098.98660063081 4098.98660063081 4098.98660063081 1 0 1 5094 11.6310112615034 0.910663314832348 0.527958190785697
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lecorguille
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2163 M334T4044 334.399993896484 334.399993896484 334.399993896484 4043.65478609327 4043.65478609327 4043.65478609327 1 0 1 4111 Inf 2.88958383811827 0.212102581928412
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lecorguille
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2164 M334T4182 334.5 334.5 334.5 4181.68550617079 4181.68550617079 4181.68550617079 1 1 0 6003 Inf -1 0.5
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2166 M335T3980 334.899993896484 334.899993896484 334.899993896484 3980.06774049765 3979.40010723888 3980.73537375642 2 1 1 2071 1.05843205775147 0.102448613370046 0.934838131603807
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lecorguille
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2167 M335T2845 334.899993896484 334.899993896484 334.899993896484 2844.89379581084 2844.89379581084 2844.89379581084 1 1 0 5525 Inf -1 0.5
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lecorguille
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2168 M335T4141 334.899993896484 334.899993896484 334.899993896484 4141.37597099195 4141.37597099195 4141.37597099195 1 0 1 4214 Inf 1 0.5
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lecorguille
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2169 M335T3907 334.899993896484 334.899993896484 334.899993896484 3906.7944394378 3906.7944394378 3906.7944394378 1 1 0 4824 5.54676260402891 -0.806709331078594 0.561080343030325
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2170 M335T3787 334.899993896484 334.899993896484 334.899993896484 3786.9165542971 3786.9165542971 3786.9165542971 1 1 0 4451 Inf -1 0.5
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lecorguille
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2173 M335T3510 335 335 335 3510.29426291687 3510.29426291687 3510.29426291687 1 1 0 4523 3.09111463750827 -0.663871756331468 0.620379896031853
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2174 M335T2535 335.200012207031 335.200012207031 335.200012207031 2534.99208488001 2534.99208488001 2534.99208488001 1 0 1 5778 Inf 4.64651521610995 0.134951740654892
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lecorguille
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2175 M335T3859 335.200012207031 335.200012207031 335.200012207031 3859.16718389147 3859.16718389147 3859.16718389147 1 0 1 [M+Cl]- 300.234 21 4.60300498405109 2.35413978152408 0.14546560132442
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2176 M335T3873 335.300018310547 335.300018310547 335.300018310547 3873.18822164528 3873.18822164528 3873.18822164528 1 1 0 2739 3.6007541521008 -0.695940542156877 0.599931860494388
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2177 M335T3531 335.300018310547 335.300018310547 335.300018310547 3531.41514892439 3531.41514892439 3531.41514892439 1 0 1 1953 Inf 2.76748582839631 0.220741711895927
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2178 M335T3634 335.300018310547 335.300018310547 335.300018310547 3634.20281432393 3634.20281432393 3634.20281432393 1 1 0 2361 2.93438126800458 -1.51946862053659 0.274488117813938
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2179 M335T4092 335.399993896484 335.399993896484 335.399993896484 4092.39294372743 4092.39294372743 4092.39294372743 1 1 0 4962 Inf -1 0.5
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2180 M335T3908 335.399993896484 335.399993896484 335.399993896484 3907.5377840068 3907.5377840068 3907.5377840068 1 1 0 4796 Inf -2.44997792059449 0.246707324348057
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2181 M336T4074 335.800018310547 335.800018310547 335.800018310547 4074.17695874045 4074.17695874045 4074.17695874045 1 0 1 3852 6.88263765857678 0.845825759764879 0.548375717797612
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2182 M336T2783 336 336 336 2782.82387616654 2782.06165462036 2783.58609771271 2 1 1 142 1.91655104136146 -0.631217903247375 0.599145141279742
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2183 M336T3069 336 336 336 3069.25642434394 3069.25642434394 3069.25642434394 1 0 1 2415 2.11658694452868 0.768743212192396 0.579279979555373
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2184 M336T2941 336 336 336 2940.78734433934 2940.78734433934 2940.78734433934 1 1 0 57 Inf -1 0.5
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lecorguille
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2185 M336T3055 336 336 336 3054.96586293458 3054.96586293458 3054.96586293458 1 1 0 3487 26.415079777426 -1.40535994611471 0.39268662563971
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2186 M336T3966 336 336 336 3966.39877145841 3966.39877145841 3966.39877145841 1 0 1 2023 Inf 1 0.5
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lecorguille
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2187 M336T3191 336.100006103516 336.100006103516 336.100006103516 3190.88909776473 3190.88909776473 3190.88909776473 1 0 1 2214 1.02587732698542 -0.0323376867183182 0.9787768689201
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2188 M336T3695 336.200012207031 336.200012207031 336.200012207031 3694.98442994032 3694.98442994032 3694.98442994032 1 0 1 571 1.10583347289333 -0.25345017487349 0.829434614000588
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2189 M336T3614 336.200012207031 336.200012207031 336.200012207031 3613.64356598996 3613.64356598996 3613.64356598996 1 1 0 [35][M]- 2581 38.4406830155218 -1.00445148429913 0.498585144554438
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2190 M336T2988 336.200012207031 336.200012207031 336.200012207031 2987.64762042777 2987.64762042777 2987.64762042777 1 1 0 124 11.7960539330859 -1.06852855087304 0.4788572320315
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2191 M336T3429 336.300018310547 336.300018310547 336.300018310547 3429.04976846144 3429.04976846144 3429.04976846144 1 1 0 5262 1.13093473073362 -0.0867324118472476 0.938890624680351
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2192 M336T2911 336.300018310547 336.300018310547 336.300018310547 2911.35091177865 2911.35091177865 2911.35091177865 1 1 0 56 Inf -1.96077535459218 0.30024097274639
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lecorguille
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2193 M336T3068 336.300018310547 336.300018310547 336.300018310547 3067.53512285022 3067.53512285022 3067.53512285022 1 1 0 2428 Inf -1 0.5
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lecorguille
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2194 M336T2734 336.300018310547 336.300018310547 336.300018310547 2734.32076782363 2734.32076782363 2734.32076782363 1 0 1 2475 Inf 1 0.5
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lecorguille
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2195 M336T3790 336.399993896484 336.399993896484 336.399993896484 3789.65430237007 3789.65430237007 3789.65430237007 1 0 1 4452 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2196 M336T4083 336.5 336.5 336.5 4083.05475077153 4083.05475077153 4083.05475077153 1 0 1 5721 Inf 1 0.5
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lecorguille
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2197 M337T3869 336.899993896484 336.899993896484 336.899993896484 3868.62782436996 3868.62782436996 3868.62782436996 1 0 1 1372 Inf 1 0.5
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lecorguille
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2198 M337T4083 336.899993896484 336.899993896484 336.899993896484 4082.98442099473 4082.98442099473 4082.98442099473 1 1 0 5722 Inf -5.04959035352507 0.124463149690172
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lecorguille
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2199 M337T2794 336.899993896484 336.899993896484 336.899993896484 2794.48110315048 2794.48110315048 2794.48110315048 1 1 0 912 Inf -1 0.5
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lecorguille
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2200 M337T2960 337 337 337 2959.50397850139 2959.50397850139 2959.50397850139 1 1 0 [36][M]- 72 2.91205760352581 -0.825264534829741 0.55533673478749
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2201 M337T3400 337 337 337 3400.28400782388 3400.28400782388 3400.28400782388 1 1 0 1316 Inf -1.80598420279737 0.321932706714677
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lecorguille
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2202 M337T2893 337.100006103516 337.100006103516 337.100006103516 2893.43940086615 2893.43940086615 2893.43940086615 1 0 1 3828 6.04400208529189 4.46078067773647 0.0755738739508223
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lecorguille
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2203 M337T3450 337.100006103516 337.100006103516 337.100006103516 3449.96680165415 3449.96680165415 3449.96680165415 1 0 1 3330 1.74300822040794 1.07578847074304 0.472045766454757
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2204 M337T3650 337.100006103516 337.100006103516 337.100006103516 3650.36232946302 3650.36232946302 3650.36232946302 1 1 0 24 1.08742027848963 -0.119458048548142 0.915943775541596
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lecorguille
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2205 M337T3430 337.200012207031 337.200012207031 337.200012207031 3430.28109649728 3426.54367673877 3434.01851625578 2 0 2 5263 Inf 2.71230120077809 0.224871746987843
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2206 M337T3714 337.200012207031 337.200012207031 337.200012207031 3713.77679570678 3713.77679570678 3713.77679570678 1 0 1 1160 27.7613651461375 2.32557764710063 0.25553342705144
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2207 M337T3388 337.200012207031 337.200012207031 337.200012207031 3387.92802216455 3387.92802216455 3387.92802216455 1 1 0 477 1.13427483873662 0.133241073122795 0.915169446770447
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2208 M337T3059 337.200012207031 337.200012207031 337.200012207031 3058.62093932681 3058.62093932681 3058.62093932681 1 0 1 209 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2209 M337T3615 337.200012207031 337.200012207031 337.200012207031 3615.18616174967 3615.18616174967 3615.18616174967 1 1 0 [35][M+1]- 2563 30.4143489942322 -1.11075296615485 0.466549594269833
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2210 M337T3917 337.300018310547 337.300018310547 337.300018310547 3916.86998621818 3916.86998621818 3916.86998621818 1 1 0 5134 2.35699390751852 -0.636036606010184 0.617045393593222
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2211 M338T3332 337.899993896484 337.899993896484 337.899993896484 3332.36652959154 3332.36652959154 3332.36652959154 1 0 1 1099 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2212 M338T2644 337.899993896484 337.899993896484 337.899993896484 2644.0477303424 2644.0477303424 2644.0477303424 1 0 1 5653 1.4533887709857 0.256996564644445 0.823874674840487
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2213 M338T3335 338 338 338 3335.19806238107 3335.19806238107 3335.19806238107 1 1 0 [M-H]- 339.006 15 1.52010444389313 -0.735837721063595 0.538600133334303
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2214 M338T2887 338 338 338 2886.97775847116 2886.97775847116 2886.97775847116 1 0 1 194 2.41136081455611 0.991148015809382 0.489689155272967
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2215 M338T3402 338 338 338 3402.15105878127 3402.15105878127 3402.15105878127 1 1 0 1317 1.45193499008705 0.45178095826002 0.729779438758957
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2216 M338T2958 338 338 338 2957.94240686028 2957.94240686028 2957.94240686028 1 1 0 [36][M+1]- 3254 14.014789478044 -1.40968501551403 0.388858065118749
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2217 M338T3022 338.100006103516 338.100006103516 338.100006103516 3021.61189621512 3020.50807346328 3022.53127961302 4 2 2 [37][M]- [M-H]- 339.11 39 1.12264428727109 -0.976161774108966 0.489549063521638
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2218 M338T2789 338.100006103516 338.100006103516 338.100006103516 2789.01839269148 2788.02229392021 2790.01449146275 2 0 2 [M-H-CO]- 367.108 12 1.25558906884329 0.708375639510685 0.59368831417507
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2219 M338T3664 338.200012207031 338.200012207031 338.200012207031 3663.99199932066 3662.1109145882 3668.80508470333 4 2 2 [3M-H+Cl]2- 214.136 2 1.02162765234366 0.297781271493653 0.814358848337432
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2220 M338T3835 338.200012207031 338.200012207031 338.200012207031 3834.52622321829 3829.49691777331 3837.88027385375 4 2 2 3344 1.44691326447197 -0.384527437115351 0.755786018052473
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2221 M338T3293 338.200012207031 338.200012207031 338.200012207031 3292.87566532584 3292.87566532584 3292.87566532584 1 1 0 205 3.41954672645153 -2.04822058188225 0.200474260488294
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2222 M338T2703 338.200012207031 338.200012207031 338.200012207031 2703.19511579694 2703.19511579694 2703.19511579694 1 1 0 4866 Inf -3.04251905014023 0.202160026487589
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2223 M338T3208 338.200012207031 338.200012207031 338.200012207031 3208.3511612646 3208.3511612646 3208.3511612646 1 1 0 4282 2.46383359184259 -1.45392713022644 0.378961193152719
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2224 M338T3258 338.300018310547 338.300018310547 338.300018310547 3257.51410443234 3257.51410443234 3257.51410443234 1 0 1 3601 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2225 M338T3349 338.300018310547 338.300018310547 338.300018310547 3349.29618456545 3349.29618456545 3349.29618456545 1 1 0 693 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2226 M339T2771 339 339 339 2771.04042670827 2771.04042670827 2771.04042670827 2 1 0 151 3.66019856327168 -3.40059313954062 0.148123135118744
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2227 M339T4149 339 339 339 4148.8084114526 4148.8084114526 4148.8084114526 1 1 0 289 Inf -1 0.5
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lecorguille
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2228 M339T4162 339 339 339 4161.88674762692 4161.88674762692 4161.88674762692 1 0 1 6035 2.1100428877297 0.475390658819648 0.697042011785493
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lecorguille
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2229 M339T2909 339 339 339 2909.41319283123 2909.41319283123 2909.41319283123 1 0 1 2767 4.07833457773985 1.08322050097078 0.441849629390107
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2230 M339T2605 339 339 339 2604.71128676082 2604.71128676082 2604.71128676082 1 1 0 [M+Cl]- 304.033 157 Inf -18.9168053244696 0.0336223660421284
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lecorguille
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2231 M339T3277 339.100006103516 339.100006103516 339.100006103516 3276.55852937273 3276.55852937273 3276.55852937273 1 0 1 1241 2.36239648071907 0.960357873566389 0.509171421783372
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2232 M339T3313 339.100006103516 339.100006103516 339.100006103516 3313.1520157047 3313.1520157047 3313.1520157047 1 1 0 528 Inf -1 0.5
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lecorguille
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2233 M339T3129 339.100006103516 339.100006103516 339.100006103516 3128.94073315599 3128.94073315599 3128.94073315599 1 0 1 163 8.7831969828537 0.880458066803663 0.537401355241429
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
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2234 M339T3245 339.100006103516 339.100006103516 339.100006103516 3244.72530807952 3244.72530807952 3244.72530807952 1 0 1 80 7.56744721203768 2.26793721611375 0.220314764140629
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
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2235 M339T3779 339.100006103516 339.100006103516 339.100006103516 3779.2435506004 3779.2435506004 3779.2435506004 1 1 0 3671 8.35488613097679 -1.01390907349188 0.490554353694826
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2236 M339T3024 339.100006103516 339.100006103516 339.100006103516 3023.66244667799 3023.66244667799 3023.66244667799 1 1 0 [37][M+1]- 2117 2.56912492296937 -0.968574408780446 0.500593231392973
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2237 M339T3315 339.200012207031 339.200012207031 339.200012207031 3315.00429010249 3302.10240780312 3325.76027288814 5 2 2 4 1.65917787923469 1.38162129014594 0.368813233388765
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
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2238 M339T3784 339.200012207031 339.200012207031 339.200012207031 3784.397000784 3778.5584311139 3790.23557045409 2 1 1 [M+Cl+CF3COOH]- 170.233 [M-H+CF3COOH]- 206.209 88 1.23159771910779 0.169113775614917 0.881471276973628
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2239 M339T3492 339.200012207031 339.200012207031 339.200012207031 3492.02433763762 3492.02433763762 3492.02433763762 1 1 0 [M-2H+Na]- 318.229 [M-H-CH2]- 354.211 31 1.0031738069466 -0.00784378827572682 0.995005991672278
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2240 M339T3664 339.200012207031 339.200012207031 339.200012207031 3664.0635611465 3664.0635611465 3664.0635611465 1 0 1 [M-H]- 340.206 2 1.54734035309072 0.64440794789011 0.634783555001355
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2241 M339T3038 339.200012207031 339.200012207031 339.200012207031 3037.53644882641 3037.53644882641 3037.53644882641 1 1 0 3212 3.80264426821253 -0.748226248500693 0.586245103165462
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2242 M339T3118 339.200012207031 339.200012207031 339.200012207031 3117.87471415129 3117.87471415129 3117.87471415129 1 0 1 5030 1.51560435529404 -0.37018852353498 0.756650987490342
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lecorguille
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2244 M339T4110 339.300018310547 339.300018310547 339.300018310547 4109.84516095031 4109.84516095031 4109.84516095031 1 0 1 2295 Inf 1 0.5
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2245 M339T4207 339.300018310547 339.300018310547 339.300018310547 4206.72676605947 4206.72676605947 4206.72676605947 1 1 0 4927 5.05288409278994 -0.786832255124368 0.567703246459299
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2246 M339T4192 339.300018310547 339.300018310547 339.300018310547 4191.87928300346 4191.87928300346 4191.87928300346 1 0 1 6160 4.03566203985807 0.730128042891472 0.587388759145792
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lecorguille
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2247 M339T4294 339.399993896484 339.399993896484 339.399993896484 4293.90215089905 4293.90215089905 4293.90215089905 1 0 1 282 6.50685564343317 0.836495088495002 0.551371708895512
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lecorguille
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2248 M339T4172 339.399993896484 339.399993896484 339.399993896484 4172.42311655854 4172.42311655854 4172.42311655854 1 1 0 4386 Inf -1 0.5
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2251 M340T2760 340 340 340 2760.01936767303 2760.01936767303 2760.01936767303 1 1 0 5490 Inf -1 0.5
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lecorguille
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2252 M340T3878 340 340 340 3878.30569854749 3878.30569854749 3878.30569854749 1 1 0 2740 2.03359844532804 -0.456099423678164 0.707035840673894
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lecorguille
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2253 M340T4208 340.100006103516 340.100006103516 340.100006103516 4208.29196115092 4208.29196115092 4208.29196115092 1 1 0 4928 2.72050278762361 1.00969510868181 0.427596222183512
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lecorguille
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2254 M340T3320 340.200012207031 340.200012207031 340.200012207031 3320.00602941677 3320.00602941677 3320.00602941677 1 0 1 16 1.19049775291515 1.14604755356308 0.385631913245282
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lecorguille
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2255 M340T3037 340.300018310547 340.300018310547 340.300018310547 3036.60006112552 3036.60006112552 3036.60006112552 1 0 1 3218 Inf 1 0.5
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lecorguille
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2256 M340T3531 340.300018310547 340.300018310547 340.300018310547 3531.41400476494 3531.41400476494 3531.41400476494 1 1 0 1954 4.32651622472309 -0.832085211455406 0.544548304727733
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2257 M340T3232 340.300018310547 340.300018310547 340.300018310547 3232.00873414653 3232.00873414653 3232.00873414653 1 1 0 2712 Inf -1 0.5
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2258 M340T3604 340.300018310547 340.300018310547 340.300018310547 3604.47159932894 3604.47159932894 3604.47159932894 1 1 0 1449 Inf -1.23234458338899 0.433977716651486
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lecorguille
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2259 M340T4146 340.5 340.5 340.5 4145.69322876345 4145.69322876345 4145.69322876345 1 1 0 5828 Inf -1 0.5
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lecorguille
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2260 M341T4136 340.800018310547 340.800018310547 340.800018310547 4136.24529906271 4136.24529906271 4136.24529906271 1 1 0 99 Inf -1 0.5
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lecorguille
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2261 M341T2682 340.800018310547 340.800018310547 340.800018310547 2682.04805809547 2682.04805809547 2682.04805809547 1 1 0 649 Inf -1 0.5
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lecorguille
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2262 M341T3207 340.800018310547 340.800018310547 340.800018310547 3206.78085534473 3206.78085534473 3206.78085534473 1 1 0 4289 Inf -1 0.5
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lecorguille
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2263 M341T4088 340.899993896484 340.899993896484 340.899993896484 4088.1332851457 4088.1332851457 4088.1332851457 1 0 1 4975 3.10597796026184 0.645413691181727 0.619565378711088
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lecorguille
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2264 M341T3722 340.899993896484 340.899993896484 340.899993896484 3721.5387075449 3721.5387075449 3721.5387075449 1 1 0 3439 Inf -1 0.5
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lecorguille
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2265 M341T3039 340.899993896484 340.899993896484 340.899993896484 3039.29016980688 3039.29016980688 3039.29016980688 1 1 0 3219 2.58861333716539 -0.572462346471338 0.65052881393879
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lecorguille
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2266 M341T3844 341 341 341 3844.18597732081 3844.18597732081 3844.18597732081 1 0 1 21 2.44758261891945 0.579549652566157 0.659544840062731
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lecorguille
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2267 M341T3194 341 341 341 3194.01201990731 3194.01201990731 3194.01201990731 1 0 1 30 Inf 1.29656931206551 0.418242060408745
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lecorguille
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2268 M341T3330 341 341 341 3330.4822269254 3330.4822269254 3330.4822269254 1 1 0 1100 5.61268538787211 -0.809090694029934 0.560295143928867
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lecorguille
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2269 M341T4280 341.100006103516 341.100006103516 341.100006103516 4279.81715089905 4279.81715089905 4279.81715089905 1 0 1 6105 Inf 1 0.5
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lecorguille
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2270 M341T4303 341.100006103516 341.100006103516 341.100006103516 4302.51322276304 4302.51322276304 4302.51322276304 1 1 0 293 Inf -1 0.5
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lecorguille
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2271 M341T4170 341.100006103516 341.100006103516 341.100006103516 4169.77849887679 4169.77849887679 4169.77849887679 1 0 1 5923 12.1897489656043 1.26683356939268 0.421379668205906
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lecorguille
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2272 M341T2897 341.200012207031 341.200012207031 341.200012207031 2896.66692196751 2896.66692196751 2896.66692196751 1 0 1 3829 Inf 1 0.5
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lecorguille
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2273 M341T3309 341.200012207031 341.200012207031 341.200012207031 3308.58072998214 3308.58072998214 3308.58072998214 1 0 1 4 1.0517458177202 -0.0356556714171825 0.974802929046051
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lecorguille
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2274 M341T3692 341.200012207031 341.200012207031 341.200012207031 3691.86366065346 3691.86366065346 3691.86366065346 1 0 1 590 5.9839279614002 1.11741680980127 0.450525373153609
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lecorguille
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2275 M341T3837 341.200012207031 341.200012207031 341.200012207031 3837.09444263788 3837.09444263788 3837.09444263788 1 0 1 3161 13.1909417646516 11.4562211244898 0.0315107233993581
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lecorguille
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2276 M341T3009 341.200012207031 341.200012207031 341.200012207031 3008.71922825908 3008.71922825908 3008.71922825908 1 0 1 2081 Inf 1 0.5
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lecorguille
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2277 M341T4016 341.200012207031 341.200012207031 341.200012207031 4016.3492449455 4016.3492449455 4016.3492449455 1 1 0 [M+Cl]- 306.227 242 2.23105616436035 -0.740719081233007 0.58990291915429
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lecorguille
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2278 M341T3604 341.200012207031 341.200012207031 341.200012207031 3603.95173908987 3603.95173908987 3603.95173908987 1 0 1 22 2.56749613112685 1.4128660783131 0.335606762947049
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lecorguille
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2279 M341T3546 341.200012207031 341.200012207031 341.200012207031 3546.43288433903 3546.43288433903 3546.43288433903 1 0 1 44 1.37015342445924 1.51356693158757 0.325028478385965
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lecorguille
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2280 M341T4124 341.300018310547 341.300018310547 341.300018310547 4123.7969081451 4123.7969081451 4123.7969081451 1 0 1 1718 6.16409352201878 1.14317498395741 0.443436044532084
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lecorguille
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2281 M341T3470 341.300018310547 341.300018310547 341.300018310547 3469.95668653736 3469.95668653736 3469.95668653736 1 1 0 3102 Inf -1 0.5
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lecorguille
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2282 M341T4172 341.399993896484 341.399993896484 341.399993896484 4172.42311655854 4172.42311655854 4172.42311655854 1 1 0 4369 Inf -1 0.5
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lecorguille
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2283 M342T4058 341.899993896484 341.899993896484 341.899993896484 4057.51143041705 4057.51143041705 4057.51143041705 1 1 0 3421 Inf -1 0.5
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lecorguille
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2284 M342T4143 341.899993896484 341.899993896484 341.899993896484 4142.54464326502 4142.54464326502 4142.54464326502 1 1 0 4215 Inf -1 0.5
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lecorguille
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2285 M342T4181 342 342 342 4180.82775880486 4180.82775880486 4180.82775880486 1 0 1 6004 Inf 1 0.5
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lecorguille
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2286 M342T3806 342 342 342 3805.94724681567 3805.94724681567 3805.94724681567 1 1 0 108 4.41090942024194 -0.754151388223224 0.578892126056367
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lecorguille
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2287 M342T4224 342.100006103516 342.100006103516 342.100006103516 4224.25163605005 4224.25163605005 4224.25163605005 1 1 0 5421 Inf -1 0.5
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lecorguille
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2288 M342T2720 342.200012207031 342.200012207031 342.200012207031 2720.41835712728 2715.94157338643 2724.89514086813 2 0 2 49 21.966230957111 1.77593851460545 0.323804918543255
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lecorguille
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2289 M342T3445 342.200012207031 342.200012207031 342.200012207031 3445.15406780025 3445.15406780025 3445.15406780025 1 0 1 [M+Cl]- 307.225 62 1.47934619916194 1.35061634290648 0.326237346638675
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2290 M342T2850 342.200012207031 342.200012207031 342.200012207031 2849.62933919511 2849.62933919511 2849.62933919511 1 1 0 5770 1.50388807279024 -0.295700426318133 0.802695828986473
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lecorguille
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2291 M342T2576 342.200012207031 342.200012207031 342.200012207031 2576.24897459635 2576.24897459635 2576.24897459635 1 1 0 104 1.64377908218898 -0.334593952278515 0.775546772559258
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lecorguille
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2292 M342T3635 342.300018310547 342.300018310547 342.300018310547 3635.44485931086 3631.25754203364 3639.63217658808 2 1 1 2847 2.22013056706153 -0.721370976045406 0.551434590200668
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lecorguille
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2293 M342T3692 342.300018310547 342.300018310547 342.300018310547 3692.26549459042 3692.26549459042 3692.26549459042 1 1 0 591 Inf -1 0.5
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lecorguille
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2294 M342T3328 342.300018310547 342.300018310547 342.300018310547 3327.51545270666 3327.51545270666 3327.51545270666 1 0 1 15 8.49454583197736 1.15042529625777 0.448647289569581
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2295 M342T2817 342.300018310547 342.300018310547 342.300018310547 2816.76565493125 2816.76565493125 2816.76565493125 1 0 1 3317 Inf 4.06727017274176 0.153478377418065
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lecorguille
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2296 M342T3038 342.300018310547 342.300018310547 342.300018310547 3038.15131755569 3038.15131755569 3038.15131755569 1 0 1 3220 Inf 1 0.5
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2297 M342T2930 342.300018310547 342.300018310547 342.300018310547 2929.96472679346 2929.96472679346 2929.96472679346 1 0 1 3625 Inf 1 0.5
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2298 M342T3154 342.300018310547 342.300018310547 342.300018310547 3153.54363378706 3153.54363378706 3153.54363378706 1 1 0 3034 4.51492891592144 -1.2145760283006 0.404066391142422
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2299 M342T2970 342.300018310547 342.300018310547 342.300018310547 2969.89649835987 2969.89649835987 2969.89649835987 1 0 1 3255 1.51811778240144 0.285012355079981 0.806059055082906
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lecorguille
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2300 M342T4047 342.399993896484 342.399993896484 342.399993896484 4046.80737474064 4046.80737474064 4046.80737474064 1 0 1 4112 4.30027281824373 0.747511336023516 0.581216142745068
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2301 M342T3181 342.399993896484 342.399993896484 342.399993896484 3181.37964662454 3181.37964662454 3181.37964662454 1 0 1 2186 Inf 1 0.5
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2302 M343T4122 342.899993896484 342.899993896484 342.899993896484 4122.45552011977 4122.45552011977 4122.45552011977 1 0 1 1719 Inf 1 0.5
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2303 M343T2682 343 343 343 2682.43488848373 2681.23206234307 2685.68075810517 4 2 2 [38][M]- [M-H]- 344.012 6 1.14229033128922 -0.726925245485786 0.588709865511621
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2304 M343T3712 343 343 343 3712.28728409084 3712.28728409084 3712.28728409084 1 1 0 1176 Inf -1 0.5
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2305 M343T2891 343 343 343 2891.00277522199 2891.00277522199 2891.00277522199 1 1 0 [39][M]- [M-H]- 344.006 95 2.7908041917961 -0.879604228353974 0.539996262392486
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2306 M343T3763 343 343 343 3762.94929187377 3762.94929187377 3762.94929187377 1 1 0 977 2.49838012330009 -1.49431139095828 0.373571970697834
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lecorguille
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2307 M343T3787 343 343 343 3786.9165542971 3786.9165542971 3786.9165542971 1 1 0 117 2.9083753806909 -1.43799797546483 0.289158061231037
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lecorguille
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2308 M343T2764 343.100006103516 343.100006103516 343.100006103516 2763.86959840856 2763.86959840856 2763.86959840856 1 0 1 3820 1.28313647917279 0.264040219014482 0.819402695762221
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2309 M343T3266 343.200012207031 343.200012207031 343.200012207031 3265.92935407562 3265.92935407562 3265.92935407562 1 1 0 85 8.92912570315018 -1.18683575952191 0.439035889124937
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lecorguille
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2310 M343T3185 343.200012207031 343.200012207031 343.200012207031 3184.64481211908 3184.64481211908 3184.64481211908 1 0 1 2187 Inf 1 0.5
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lecorguille
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2311 M343T4172 343.300018310547 343.300018310547 343.300018310547 4172.42311655854 4172.42311655854 4172.42311655854 1 1 0 115 1.85822586321807 -0.406700856297597 0.7337527349397
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lecorguille
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2312 M344T4155 343.5 343.5 343.5 4155.1333779925 4155.1333779925 4155.1333779925 1 1 0 6209 Inf -1 0.5
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lecorguille
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2313 M344T4020 343.899993896484 343.899993896484 343.899993896484 4020.00883866426 4020.00883866426 4020.00883866426 1 0 1 5572 Inf 1 0.5
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lecorguille
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2314 M344T2683 344 344 344 2682.82707048043 2682.4546014594 2683.62713632746 4 2 2 [38][M+1]- 6 1.13355181392864 -0.60699017348046 0.644156144292546
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lecorguille
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2315 M344T3386 344 344 344 3386.39900087428 3383.32875490952 3389.46924683903 2 1 1 1556 1.13349240201067 -0.101107154806033 0.928865215105151
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lecorguille
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2316 M344T2893 344 344 344 2892.58722465327 2892.58722465327 2892.58722465327 1 1 0 [39][M+1]- 95 6.70381848039701 -1.0508615044184 0.482761013125627
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2317 M344T3532 344 344 344 3532.30258261548 3532.30258261548 3532.30258261548 1 0 1 1955 Inf 1 0.5
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2318 M344T3275 344 344 344 3275.12473374223 3275.12473374223 3275.12473374223 1 1 0 5007 13.6602006483524 -2.6620463653636 0.211423233534846
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lecorguille
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2319 M344T3131 344.100006103516 344.100006103516 344.100006103516 3131.41912817091 3131.41912817091 3131.41912817091 1 0 1 4993 1.13844062570068 0.115146549124003 0.920354200137905
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2320 M344T2644 344.100006103516 344.100006103516 344.100006103516 2643.99065623712 2643.99065623712 2643.99065623712 1 1 0 5654 1.18406721147154 -0.966827753569266 0.46616737516407
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2321 M344T2707 344.100006103516 344.100006103516 344.100006103516 2706.96523737293 2706.96523737293 2706.96523737293 1 0 1 4867 4.11510920366878 1.36763594507916 0.398825793894455
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2322 M344T3158 344.100006103516 344.100006103516 344.100006103516 3158.12108870158 3158.12108870158 3158.12108870158 1 0 1 10 2.6214082922864 0.609847812395204 0.636032187386518
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lecorguille
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2323 M344T2760 344.200012207031 344.200012207031 344.200012207031 2759.86207611697 2754.31880482682 2765.40534740713 2 1 1 176 2.7784807819278 0.684346501808384 0.602469540668906
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lecorguille
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2324 M344T3688 344.200012207031 344.200012207031 344.200012207031 3687.56722213417 3687.56722213417 3687.56722213417 1 1 0 [40][M]- 5 3.7199150166862 -1.81771436740614 0.319836719035475
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2325 M344T3236 344.200012207031 344.200012207031 344.200012207031 3236.11056310733 3236.11056310733 3236.11056310733 1 1 0 2699 3.63862229237462 -2.140244703051 0.178241697653162
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lecorguille
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2326 M344T3350 344.200012207031 344.200012207031 344.200012207031 3349.84145386457 3349.84145386457 3349.84145386457 1 0 1 703 12.405656122882 0.969830416701648 0.509387971550514
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lecorguille
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2327 M344T3571 344.300018310547 344.300018310547 344.300018310547 3570.5915589332 3570.5915589332 3570.5915589332 1 0 1 1663 Inf 1 0.5
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lecorguille
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2328 M344T3924 344.399993896484 344.399993896484 344.399993896484 3924.24053454928 3924.24053454928 3924.24053454928 1 1 0 2950 1.28017450384494 -0.172473162181774 0.879757586830194
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lecorguille
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2329 M345T2682 345 345 345 2681.64534936774 2680.84636101147 2682.82633158321 4 2 2 [38][M+2]- 6 1.1258425062644 0.277952656547898 0.821122869748294
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lecorguille
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2330 M345T3101 345 345 345 3101.3386305363 3101.3386305363 3101.3386305363 1 0 1 3134 2.74377587595861 0.597116780838589 0.639697410590848
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lecorguille
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2331 M345T3749 345 345 345 3748.75724616318 3748.75724616318 3748.75724616318 1 0 1 1028 Inf 1.64531193294728 0.347674561381568
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lecorguille
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2332 M345T3818 345 345 345 3818.15413877184 3818.15413877184 3818.15413877184 1 0 1 2382 Inf 1 0.5
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lecorguille
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2333 M345T3788 345 345 345 3788.06929478123 3788.06929478123 3788.06929478123 1 0 1 4445 1.60960301565199 -0.549552787387741 0.65574470889549
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lecorguille
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2334 M345T2592 345 345 345 2592.045668269 2592.045668269 2592.045668269 1 0 1 61 1.10563982218722 -1.03376621814159 0.437752696790068
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lecorguille
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2335 M345T3845 345.200012207031 345.200012207031 345.200012207031 3845.36750400072 3841.8240416177 3848.91096638375 2 0 2 [M+Cl+NaCOOH]- 242.234 21 2.04657356056071 0.755078255550326 0.539826013608561
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lecorguille
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2336 M345T3684 345.200012207031 345.200012207031 345.200012207031 3684.43949723506 3684.43949723506 3684.43949723506 1 1 0 [40][M+1]- 5 2.4116149466494 -1.00839892395933 0.494304596920712
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lecorguille
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2337 M345T4090 345.200012207031 345.200012207031 345.200012207031 4089.68382733714 4089.68382733714 4089.68382733714 1 0 1 4976 2.18844457674305 -0.529938272825274 0.683179217889965
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lecorguille
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2338 M345T3384 345.200012207031 345.200012207031 345.200012207031 3383.56052059626 3383.56052059626 3383.56052059626 1 1 0 25 4.13097591518911 -10.1706851417009 0.0571235168032325
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lecorguille
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2339 M345T3256 345.300018310547 345.300018310547 345.300018310547 3256.43182590051 3256.43182590051 3256.43182590051 1 1 0 34 3.75467691015836 -0.70895183349237 0.595092080862498
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lecorguille
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2340 M345T4116 345.300018310547 345.300018310547 345.300018310547 4115.90921963138 4115.90921963138 4115.90921963138 1 1 0 2296 Inf -1 0.5
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lecorguille
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2341 M345T3687 345.300018310547 345.300018310547 345.300018310547 3687.18932031058 3687.18932031058 3687.18932031058 1 0 1 592 1.02954623072936 0.020586007074326 0.985446439446047
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lecorguille
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2342 M345T3913 345.399993896484 345.399993896484 345.399993896484 3913.24808890367 3909.62619158916 3916.86998621818 2 1 1 5134 1.31422474419796 0.380608462984633 0.758588910546194
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lecorguille
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2343 M346T3966 345.600006103516 345.600006103516 345.600006103516 3965.53406356649 3965.53406356649 3965.53406356649 1 1 0 2024 Inf -1 0.5
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lecorguille
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2344 M346T3332 345.899993896484 345.899993896484 345.899993896484 3332.27914258093 3332.27914258093 3332.27914258093 1 0 1 15 Inf 1 0.5
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lecorguille
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2345 M346T3908 345.899993896484 345.899993896484 345.899993896484 3907.5377840068 3907.5377840068 3907.5377840068 1 1 0 4795 Inf -1.40084289571352 0.394681873664737
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lecorguille
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2346 M346T4068 345.899993896484 345.899993896484 345.899993896484 4067.97158561998 4067.97158561998 4067.97158561998 1 0 1 3877 3.67656728158278 0.892150330162419 0.511151119831877
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lecorguille
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2347 M346T3867 345.899993896484 345.899993896484 345.899993896484 3867.25281011878 3867.25281011878 3867.25281011878 1 1 0 1373 Inf -1 0.5
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lecorguille
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2348 M346T3861 346 346 346 3860.74392381963 3860.74392381963 3860.74392381963 1 0 1 1374 1.35472453650407 0.21066547274321 0.854145237410562
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lecorguille
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2349 M346T2995 346 346 346 2995.47278221695 2995.47278221695 2995.47278221695 1 1 0 1835 Inf -1 0.5
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lecorguille
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2350 M346T3495 346.100006103516 346.100006103516 346.100006103516 3495.17704252179 3495.17704252179 3497.82302203774 3 2 0 82 2.08119196123918 -3.32892244610665 0.0846560821845734
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lecorguille
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2351 M346T3840 346.100006103516 346.100006103516 346.100006103516 3840.24749080167 3840.24749080167 3840.24749080167 1 0 1 3162 1.27716976758396 0.321639046053081 0.779074433728693
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lecorguille
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2352 M346T3499 346.200012207031 346.200012207031 346.200012207031 3499.05491903575 3499.05491903575 3499.05491903575 1 0 1 [M-H]- 347.211 76 11.9129121929656 2.44909243625312 0.246679373090627
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lecorguille
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2353 M346T3482 346.200012207031 346.200012207031 346.200012207031 3482.36454836522 3482.36454836522 3482.36454836522 1 1 0 31 1.16866158205253 0.170656729548857 0.881398368790329
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lecorguille
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2354 M346T2518 346.200012207031 346.200012207031 346.200012207031 2518.492668269 2518.492668269 2518.492668269 1 0 1 5048 1.21267069621671 0.135303506536185 0.905157022093483
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lecorguille
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2355 M346T2950 346.200012207031 346.200012207031 346.200012207031 2950.139046458 2950.139046458 2950.139046458 1 1 0 3175 Inf -32.7741429497576 0.0194184276584546
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lecorguille
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2356 M346T2639 346.200012207031 346.200012207031 346.200012207031 2639.28670073956 2639.28670073956 2639.28670073956 1 0 1 222 Inf 1 0.5
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lecorguille
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2357 M346T3021 346.300018310547 346.300018310547 346.300018310547 3020.50807346328 3020.50807346328 3020.50807346328 1 1 0 2142 Inf -1 0.5
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lecorguille
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2358 M346T3943 346.300018310547 346.300018310547 346.300018310547 3943.29195691142 3943.29195691142 3943.29195691142 1 1 0 4143 1.07442669077958 -0.0614673787794421 0.958142224265085
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lecorguille
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2359 M347T3936 346.800018310547 346.800018310547 346.800018310547 3936.43507866832 3936.43507866832 3936.43507866832 1 0 1 4144 Inf 1 0.5
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lecorguille
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2360 M347T4070 346.800018310547 346.800018310547 346.800018310547 4069.52308650706 4069.52308650706 4069.52308650706 1 0 1 3878 Inf 1 0.5
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lecorguille
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2361 M347T2771 346.899993896484 346.899993896484 346.899993896484 2770.79515073833 2765.83639925996 2775.7539022167 2 1 1 5129 1.39560042283795 -0.247081932877861 0.833207727317582
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lecorguille
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2362 M347T3133 346.899993896484 346.899993896484 346.899993896484 3133.24690555716 3133.24690555716 3133.24690555716 1 1 0 144 Inf -1 0.5
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lecorguille
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2363 M347T2614 346.899993896484 346.899993896484 346.899993896484 2614.10128676082 2614.10128676082 2614.10128676082 1 1 0 5802 Inf -1 0.5
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lecorguille
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2364 M347T4038 346.899993896484 346.899993896484 346.899993896484 4038.4655434023 4038.4655434023 4038.4655434023 1 0 1 3764 Inf 1.60763073975288 0.354255461939161
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2365 M347T3585 346.899993896484 346.899993896484 346.899993896484 3585.11750339809 3585.11750339809 3585.11750339809 1 0 1 1698 Inf 1 0.5
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2366 M347T4012 346.899993896484 346.899993896484 346.899993896484 4011.58991179848 4011.58991179848 4011.58991179848 1 1 0 5214 Inf -2.60442151807199 0.23338792383097
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lecorguille
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2367 M347T3343 347 347 347 3343.45213808074 3343.45213808074 3343.45213808074 1 0 1 9 1.23022338900271 0.218454359682432 0.863042994002886
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2368 M347T3397 347 347 347 3397.12897169193 3397.12897169193 3397.12897169193 1 0 1 478 Inf 1 0.5
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2369 M347T3783 347 347 347 3783.04422117973 3783.04422117973 3783.04422117973 1 0 1 3672 4.10599755952448 0.734970513247605 0.585656034909679
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lecorguille
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2370 M347T3216 347 347 347 3216.21383884379 3216.21383884379 3216.21383884379 1 1 0 4290 3.11405995227911 -4.51096391113061 0.135802570496894
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lecorguille
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2371 M347T3467 347 347 347 3466.85812724904 3466.85812724904 3466.85812724904 1 1 0 3103 Inf -1 0.5
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lecorguille
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2372 M347T3498 347.100006103516 347.100006103516 347.100006103516 3497.93630523036 3496.75308645138 3503.64772709283 4 2 2 [M+Cl]- 312.127 76 1.70287983605257 3.06962889309572 0.101544434731289
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lecorguille
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2373 M347T3286 347.100006103516 347.100006103516 347.100006103516 3286.26441641646 3286.26441641646 3286.26441641646 1 1 0 3793 5.14113616633699 -6.5827541699609 0.095971025869102
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lecorguille
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2374 M347T2855 347.100006103516 347.100006103516 347.100006103516 2854.91573801711 2854.91573801711 2854.91573801711 1 1 0 111 4.52572027850678 -0.969521244036461 0.509717318914533
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lecorguille
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diff changeset
2375 M347T3493 347.200012207031 347.200012207031 347.200012207031 3493.04308255573 3488.56014760837 3497.52601750309 2 1 1 1787 1.54525624319564 0.643689109520757 0.611099842715381
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2376 M347T2880 347.200012207031 347.200012207031 347.200012207031 2879.95229286453 2879.95229286453 2879.95229286453 1 1 0 4729 2.37400412201846 -0.660417712707734 0.593332069975375
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lecorguille
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2377 M347T2740 347.200012207031 347.200012207031 347.200012207031 2739.56197376761 2739.56197376761 2739.56197376761 1 1 0 116 Inf -1 0.5
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lecorguille
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2378 M347T4003 347.200012207031 347.200012207031 347.200012207031 4002.95168234261 4002.95168234261 4002.95168234261 1 1 0 160 3.69800758008725 -1.46875209170354 0.298671318638552
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lecorguille
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2379 M347T2963 347.200012207031 347.200012207031 347.200012207031 2962.62793407734 2962.62793407734 2962.62793407734 1 1 0 3256 2.93577971707516 -0.624159277416029 0.628252577754264
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2380 M347T3982 347.200012207031 347.200012207031 347.200012207031 3982.3023506876 3982.3023506876 3982.3023506876 1 0 1 5539 Inf 8.25235587225072 0.0767697020568665
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lecorguille
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2381 M347T2542 347.200012207031 347.200012207031 347.200012207031 2542.11328676082 2542.11328676082 2542.11328676082 1 1 0 5159 2.09418282548476 -0.471490316683667 0.699042480124112
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lecorguille
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2382 M347T3437 347.300018310547 347.300018310547 347.300018310547 3437.49117565757 3437.49117565757 3437.49117565757 1 0 1 4890 2.28007218749108 0.514142056482407 0.677721321256727
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2383 M347T2744 347.300018310547 347.300018310547 347.300018310547 2743.50733031215 2743.50733031215 2743.50733031215 1 0 1 4599 Inf 1 0.5
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lecorguille
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2384 M347T3963 347.300018310547 347.300018310547 347.300018310547 3963.47612053684 3963.47612053684 3963.47612053684 1 0 1 1984 2.35106823450385 1.15216712587122 0.388605094018775
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2385 M347T3153 347.399993896484 347.399993896484 347.399993896484 3152.76661790971 3152.76661790971 3152.76661790971 1 0 1 3035 Inf 1 0.5
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lecorguille
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2386 M347T3980 347.399993896484 347.399993896484 347.399993896484 3979.83290448422 3979.83290448422 3979.83290448422 1 1 0 2025 Inf -1 0.5
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lecorguille
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2387 M347T3943 347.399993896484 347.399993896484 347.399993896484 3942.74331488216 3942.74331488216 3942.74331488216 1 0 1 4145 2.64445524807102 0.581652035990774 0.646446384583486
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lecorguille
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2388 M348T3353 347.800018310547 347.800018310547 347.800018310547 3352.68016128321 3352.68016128321 3352.68016128321 1 1 0 724 Inf -1 0.5
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lecorguille
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2389 M348T4094 347.800018310547 347.800018310547 347.800018310547 4094.33528157085 4094.33528157085 4094.33528157085 1 0 1 5095 Inf 1 0.5
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lecorguille
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2390 M348T3833 347.899993896484 347.899993896484 347.899993896484 3832.63372811098 3832.63372811098 3832.63372811098 1 1 0 3353 Inf -1 0.5
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lecorguille
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2391 M348T3722 347.899993896484 347.899993896484 347.899993896484 3721.63787607637 3721.63787607637 3721.63787607637 1 0 1 3440 Inf 1 0.5
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lecorguille
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2392 M348T3183 347.899993896484 347.899993896484 347.899993896484 3182.96806500915 3182.96806500915 3182.96806500915 1 0 1 2188 Inf 1 0.5
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lecorguille
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2393 M348T2787 347.899993896484 347.899993896484 347.899993896484 2786.90521866559 2786.90521866559 2786.90521866559 1 0 1 12 Inf 1.5977750794548 0.356013640333094
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lecorguille
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2394 M348T3261 348 348 348 3260.74570744212 3260.74570744212 3260.74570744212 1 1 0 3602 1.01322148272172 0.00928740187453969 0.993433085580624
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lecorguille
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2395 M348T3861 348 348 348 3860.59003269214 3860.59003269214 3860.59003269214 1 1 0 21 11.9327628866732 -0.912996766896356 0.527231494985673
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2396 M348T3468 348 348 348 3468.40698850601 3468.40698850601 3468.40698850601 1 1 0 3098 Inf -1 0.5
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lecorguille
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2397 M348T3149 348 348 348 3148.84846331748 3148.84846331748 3148.84846331748 1 1 0 3052 Inf -3.55884900798726 0.174386859079321
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lecorguille
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2398 M348T3083 348 348 348 3083.31311213932 3083.31311213932 3083.31311213932 1 0 1 3517 1.17230679108333 1.17207110778869 0.367317164125702
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lecorguille
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2399 M348T3809 348 348 348 3809.39009343097 3809.39009343097 3809.39009343097 1 1 0 90 Inf -1.68520889146529 0.340942437369804
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lecorguille
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2400 M348T3051 348 348 348 3050.57319524315 3050.57319524315 3050.57319524315 1 0 1 3488 Inf 1.30278289683068 0.416771080231373
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lecorguille
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2401 M348T3216 348 348 348 3216.21894425534 3216.21894425534 3216.21894425534 1 1 0 4314 1.67997571251449 -0.482802970348196 0.676918493202516
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2402 M348T2942 348 348 348 2942.13826084613 2942.13826084613 2942.13826084613 1 0 1 2804 2.02726586223837 0.843675049366892 0.55372009172002
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lecorguille
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2403 M348T3369 348 348 348 3369.44828355629 3369.44828355629 3369.44828355629 1 1 0 5762 6.18626365357427 -0.827608468239307 0.554243955622909
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lecorguille
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2404 M348T3423 348.100006103516 348.100006103516 348.100006103516 3422.66379466877 3422.66379466877 3422.66379466877 2 1 0 11 5.8150328670865 -0.907381408309115 0.528834667026794
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lecorguille
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2405 M348T3701 348.100006103516 348.100006103516 348.100006103516 3701.23529883703 3701.23529883703 3701.23529883703 1 0 1 109 1.65440909194863 0.797755793061007 0.568135785680513
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lecorguille
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2406 M348T3405 348.100006103516 348.100006103516 348.100006103516 3404.94031217833 3404.94031217833 3404.94031217833 1 1 0 1318 7.99003791790122 -1.02593513782409 0.49063685545755
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lecorguille
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2407 M348T3278 348.100006103516 348.100006103516 348.100006103516 3278.31156790231 3278.31156790231 3278.31156790231 1 1 0 1212 6.86597330214526 -1.66420995504381 0.342350090045849
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lecorguille
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2408 M348T3493 348.200012207031 348.200012207031 348.200012207031 3493.19473595505 3488.78600287563 3495.99683372091 3 1 2 31 2.66515312804799 3.70253659872577 0.0887023359305115
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2409 M348T4128 348.200012207031 348.200012207031 348.200012207031 4128.44542811787 4128.44542811787 4128.44542811787 1 1 0 1484 Inf -1 0.5
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lecorguille
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2410 M348T3288 348.200012207031 348.200012207031 348.200012207031 3287.85203847529 3287.85203847529 3287.85203847529 1 1 0 2096 8.90952185403443 -14.3271691155227 0.0048685139667759
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lecorguille
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2411 M348T3421 348.200012207031 348.200012207031 348.200012207031 3420.60072228854 3420.60072228854 3420.60072228854 1 1 0 [M-2H+Na]- 327.214 11 15.2801253994829 -1.52715583445687 0.36906752626389
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lecorguille
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2412 M348T4143 348.200012207031 348.200012207031 348.200012207031 4142.9532295589 4142.9532295589 4142.9532295589 1 0 1 4216 1.91058690722682 0.422259023915613 0.725165271446544
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lecorguille
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2413 M348T3720 348.300018310547 348.300018310547 348.300018310547 3720.06439350945 3720.06439350945 3720.06439350945 1 0 1 3441 Inf 1 0.5
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lecorguille
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2414 M348T3684 348.300018310547 348.300018310547 348.300018310547 3684.06687147297 3684.06687147297 3684.06687147297 1 0 1 593 Inf 1 0.5
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lecorguille
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2415 M348T3736 348.300018310547 348.300018310547 348.300018310547 3736.02301120628 3736.02301120628 3736.02301120628 1 1 0 3538 5.92830455939674 -0.82535137152948 0.557556676447855
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lecorguille
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2416 M348T3193 348.300018310547 348.300018310547 348.300018310547 3192.67421395795 3192.67421395795 3192.67421395795 1 1 0 30 Inf -1 0.5
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lecorguille
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2417 M348T3787 348.300018310547 348.300018310547 348.300018310547 3787.09400760458 3787.09400760458 3787.09400760458 1 1 0 4453 1.03890514863284 0.0269802522209889 0.980928709130678
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lecorguille
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2418 M348T4005 348.5 348.5 348.5 4005.24194327753 4005.24194327753 4005.24194327753 1 1 0 5817 Inf -1 0.5
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lecorguille
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2419 M349T4056 348.899993896484 348.899993896484 348.899993896484 4056.26458848254 4056.26458848254 4056.26458848254 1 0 1 3422 Inf 1 0.5
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lecorguille
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2420 M349T2857 348.899993896484 348.899993896484 348.899993896484 2857.46186375138 2857.46186375138 2857.46186375138 1 1 0 4256 Inf -1 0.5
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lecorguille
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2421 M349T2640 348.899993896484 348.899993896484 348.899993896484 2640.07917707564 2640.07917707564 2640.07917707564 1 0 1 5666 2.29849310367866 0.669756400739922 0.621257344724431
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lecorguille
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2422 M349T4038 348.899993896484 348.899993896484 348.899993896484 4038.4655434023 4038.4655434023 4038.4655434023 1 0 1 3765 4.55100659916781 0.762087703167224 0.5761377873791
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lecorguille
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2423 M349T3724 349 349 349 3723.50807979724 3722.22952980018 3724.7866297943 2 0 2 3442 2.37704066262502 1.25446125876383 0.380085018178187
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lecorguille
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2424 M349T4111 349 349 349 4111.42132545829 4111.42132545829 4111.42132545829 1 0 1 2297 Inf 1 0.5
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lecorguille
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2425 M349T3552 349 349 349 3551.63834287452 3551.63834287452 3551.63834287452 1 1 0 2320 1.13912074859613 0.107121684813772 0.926887355447921
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lecorguille
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2426 M349T3772 349 349 349 3772.21824064541 3772.21824064541 3772.21824064541 1 0 1 978 1.78723036408932 0.836281908257315 0.525884466699541
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lecorguille
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2427 M349T3382 349 349 349 3381.76815667381 3381.76815667381 3381.76815667381 1 1 0 1557 4.18172121253282 -0.832253508675687 0.543255674375063
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2428 M349T4099 349.200012207031 349.200012207031 349.200012207031 4098.98660063081 4098.98660063081 4098.98660063081 1 0 1 5096 1.21924514431377 0.431200922508252 0.738147844624348
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2429 M349T3406 349.200012207031 349.200012207031 349.200012207031 3406.49606836566 3406.49606836566 3406.49606836566 1 1 0 1319 12.663139168169 -1.61221512326889 0.346621713887349
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lecorguille
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2430 M349T3667 349.200012207031 349.200012207031 349.200012207031 3667.22534975723 3667.22534975723 3667.22534975723 1 0 1 2 1.46637370017108 0.401204154644021 0.749541317009619
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lecorguille
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2431 M349T3358 349.200012207031 349.200012207031 349.200012207031 3357.81958398463 3357.81958398463 3357.81958398463 1 0 1 725 2.90486228098668 0.648809733010319 0.629945651376239
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2432 M349T3511 349.300018310547 349.300018310547 349.300018310547 3510.94211515955 3510.94211515955 3510.94211515955 1 1 0 119 3.2874166609366 -1.96594224105714 0.216377077442379
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lecorguille
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2433 M349T3847 349.300018310547 349.300018310547 349.300018310547 3846.77116474985 3846.77116474985 3846.77116474985 1 1 0 [M-H]- 350.312 21 1.15399243466751 -0.152725543847703 0.902899769462213
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lecorguille
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2434 M350T2676 349.899993896484 349.899993896484 349.899993896484 2675.67789306045 2674.90732833963 2676.44845778127 2 1 1 629 1.36407453514257 0.231819250049397 0.838917480266636
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lecorguille
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2435 M350T3290 349.899993896484 349.899993896484 349.899993896484 3289.6928096902 3289.6928096902 3289.6928096902 1 0 1 2107 Inf 1 0.5
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lecorguille
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2436 M350T3506 350 350 350 3505.77314021334 3505.77314021334 3505.77314021334 1 0 1 3371 2.69904045042506 0.620641837265471 0.64176919871691
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lecorguille
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2437 M350T3539 350 350 350 3539.18883199741 3539.18883199741 3539.18883199741 1 0 1 1956 1.2494325251882 0.185120612056772 0.877518974066691
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lecorguille
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2438 M350T3976 350 350 350 3975.85959815996 3975.85959815996 3975.85959815996 1 0 1 2026 Inf 1 0.5
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lecorguille
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2439 M350T3349 350 350 350 3349.39098799884 3349.39098799884 3349.39098799884 1 0 1 726 2.69928957854984 0.628078582801454 0.64219695527224
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lecorguille
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2440 M350T3215 350 350 350 3214.6396934876 3214.6396934876 3214.6396934876 1 1 0 4315 5.30936817542082 -3.21915633147667 0.0859429097237081
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lecorguille
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2441 M350T3400 350 350 350 3400.21216836929 3400.21216836929 3400.21216836929 1 0 1 1320 1.25528403621597 -0.15906433500202 0.888871540469679
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lecorguille
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2442 M350T3845 350.100006103516 350.100006103516 350.100006103516 3844.97719520822 3844.97719520822 3844.97719520822 1 0 1 [M-H-C2H4]- 379.133 21 3.00761678335485 1.10415909855012 0.399500256042185
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lecorguille
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2443 M350T3133 350.100006103516 350.100006103516 350.100006103516 3133.24690555716 3133.24690555716 3133.24690555716 1 1 0 4987 1.6521071902272 -5.65622769241409 0.0354223325242247
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lecorguille
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2444 M350T3662 350.200012207031 350.200012207031 350.200012207031 3662.34049876889 3659.03613951767 3665.64485802011 2 1 1 2 1.25868922090484 0.266711513354327 0.831619230893796
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lecorguille
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2445 M350T3484 350.200012207031 350.200012207031 350.200012207031 3484.15058009239 3484.15058009239 3484.15058009239 1 0 1 [41][M]- [M+Cl]- 315.227 31 1.90229016027 1.01158650906001 0.478948860159285
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lecorguille
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2446 M350T3619 350.200012207031 350.200012207031 350.200012207031 3618.62698531311 3618.62698531311 3618.62698531311 1 1 0 2565 4.57895953315895 -2.53499776055998 0.200901970816845
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lecorguille
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2447 M350T3138 350.200012207031 350.200012207031 350.200012207031 3138.45569379586 3138.45569379586 3138.45569379586 1 0 1 3117 1.9209666163679 1.67465609391583 0.330986229231056
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lecorguille
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2448 M350T3536 350.300018310547 350.300018310547 350.300018310547 3536.15465906925 3536.15465906925 3536.15465906925 1 1 0 1957 4.68987847221967 -3.64021292168733 0.160370448005238
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lecorguille
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2449 M350T3945 350.300018310547 350.300018310547 350.300018310547 3944.90023893685 3944.90023893685 3944.90023893685 1 1 0 91 3.83074245086468 -0.714993830506179 0.59287272587513
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lecorguille
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2450 M350T4104 350.300018310547 350.300018310547 350.300018310547 4103.54180971343 4103.54180971343 4103.54180971343 1 0 1 288 Inf 1 0.5
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lecorguille
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2451 M350T2906 350.300018310547 350.300018310547 350.300018310547 2906.32814140451 2906.32814140451 2906.32814140451 1 0 1 3916 Inf 1 0.5
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lecorguille
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2452 M350T3627 350.300018310547 350.300018310547 350.300018310547 3626.73281907078 3626.73281907078 3626.73281907078 1 0 1 1610 Inf 1 0.5
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lecorguille
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2453 M350T3739 350.300018310547 350.300018310547 350.300018310547 3738.59240277895 3738.59240277895 3738.59240277895 1 1 0 4712 1.42585071716258 0.316494793029146 0.781896952255351
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lecorguille
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2454 M350T2970 350.300018310547 350.300018310547 350.300018310547 2970.31095643231 2970.31095643231 2970.31095643231 1 0 1 3257 Inf 1 0.5
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lecorguille
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2455 M350T4071 350.300018310547 350.300018310547 350.300018310547 4071.07447840736 4071.07447840736 4071.07447840736 1 0 1 3879 Inf 1 0.5
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lecorguille
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2456 M350T3343 350.399993896484 350.399993896484 350.399993896484 3343.45213808074 3343.45213808074 3343.45213808074 1 0 1 806 5.5745176849387 0.807719008245866 0.560747220007066
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2457 M350T3745 350.399993896484 350.399993896484 350.399993896484 3745.30239044737 3745.30239044737 3745.30239044737 1 0 1 1048 Inf 1 0.5
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lecorguille
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2458 M351T3523 350.899993896484 350.899993896484 350.899993896484 3523.20086021428 3522.87194622765 3523.52977420091 2 2 0 395 Inf -2.28741496598635 0.262374810187282
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lecorguille
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2459 M351T3757 350.899993896484 350.899993896484 350.899993896484 3757.30855694358 3757.30855694358 3757.30855694358 1 1 0 979 Inf -1 0.5
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lecorguille
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2460 M351T2593 350.899993896484 350.899993896484 350.899993896484 2593.46397459635 2593.46397459635 2593.46397459635 1 1 0 61 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2461 M351T3881 351 351 351 3881.24168085615 3881.24168085615 3881.24168085615 1 0 1 4756 Inf 1 0.5
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lecorguille
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2462 M351T3861 351 351 351 3860.59003269214 3860.59003269214 3860.59003269214 1 1 0 [M+Cl]- 316.029 21 Inf -16.8394041628441 0.0377610154458135
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lecorguille
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2463 M351T2779 351 351 351 2779.1003681637 2779.1003681637 2779.1003681637 1 0 1 112 1.80341098671322 -0.642604523662555 0.604520424988511
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lecorguille
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2464 M351T2985 351 351 351 2984.98494981884 2984.98494981884 2984.98494981884 1 1 0 4628 Inf -1 0.5
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lecorguille
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2465 M351T3497 351.100006103516 351.100006103516 351.100006103516 3497.01627875324 3495.17704252179 3497.82302203774 4 2 2 [M+Cl+HCOOH]- 270.129 [M-H+HCOOH]- 306.106 76 1.27063785830095 1.86599447899592 0.204286775816608
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lecorguille
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2466 M351T3486 351.200012207031 351.200012207031 351.200012207031 3485.71318236608 3485.71318236608 3485.71318236608 1 1 0 [41][M+1]- 1788 4.30956853507314 -0.845726876610286 0.553055292887144
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2467 M351T2603 351.200012207031 351.200012207031 351.200012207031 2603.000668269 2603.000668269 2603.000668269 1 0 1 5244 Inf 6.19961579977532 0.101810057996456
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lecorguille
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2468 M351T3037 351.300018310547 351.300018310547 351.300018310547 3036.60006112552 3036.60006112552 3036.60006112552 1 0 1 3213 Inf 2.54909304208756 0.237998866110305
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2469 M351T2992 351.300018310547 351.300018310547 351.300018310547 2992.48483717013 2992.48483717013 2992.48483717013 1 0 1 1836 Inf 1 0.5
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lecorguille
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2470 M351T3546 351.300018310547 351.300018310547 351.300018310547 3545.65886104103 3545.65886104103 3545.65886104103 1 1 0 2326 2.64829549176591 -0.630178918437129 0.627348373064335
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lecorguille
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2471 M351T4069 351.399993896484 351.399993896484 351.399993896484 4068.55467940059 4068.55467940059 4068.55467940059 1 1 0 3857 5.68296456006947 -0.811566809713119 0.559480469819732
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2472 M351T3888 351.399993896484 351.399993896484 351.399993896484 3887.79268385776 3887.79268385776 3887.79268385776 1 1 0 2233 Inf -1 0.5
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lecorguille
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2473 M352T2728 351.899993896484 351.899993896484 351.899993896484 2728.39367895811 2728.39367895811 2728.39367895811 2 0 1 2467 3.42694852728901 0.867299294497304 0.531004028437889
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2474 M352T2644 351.899993896484 351.899993896484 351.899993896484 2644.46562016774 2644.46562016774 2644.46562016774 1 1 0 193 Inf -1 0.5
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lecorguille
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2475 M352T3116 351.899993896484 351.899993896484 351.899993896484 3115.60517307867 3115.60517307867 3115.60517307867 1 0 1 5031 2.10735497210541 0.474733296418543 0.697378455088137
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2476 M352T4148 351.899993896484 351.899993896484 351.899993896484 4147.68554886694 4147.68554886694 4147.68554886694 1 0 1 5626 1.84096233639892 0.401408638016797 0.736709538623622
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lecorguille
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2477 M352T2565 351.899993896484 351.899993896484 351.899993896484 2565.29497459635 2565.29497459635 2565.29497459635 1 1 0 223 1.7113931435768 -0.642214780947789 0.608088229753374
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2478 M352T3739 352 352 352 3739.40336407542 3739.40336407542 3739.40336407542 1 0 1 4713 6.83195892444187 0.932488016401359 0.515926993208637
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2479 M352T3503 352 352 352 3502.67787245347 3502.67787245347 3502.67787245347 1 0 1 3372 Inf 1 0.5
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lecorguille
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2480 M352T3946 352 352 352 3946.46210291131 3946.46210291131 3946.46210291131 1 1 0 3735 1.93385938792169 -0.428944323495467 0.721523789509243
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lecorguille
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2481 M352T3493 352.100006103516 352.100006103516 352.100006103516 3493.41928953181 3490.10642571042 3494.46617918035 5 2 2 31 4.03901407060107 -1.19499668937898 0.44357089935272
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lecorguille
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2482 M352T3203 352.100006103516 352.100006103516 352.100006103516 3202.5875583099 3202.5875583099 3202.5875583099 1 1 0 2173 17.7477733879873 -1.0581910303 0.481843191862706
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lecorguille
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2483 M352T3289 352.200012207031 352.200012207031 352.200012207031 3289.43873665169 3289.43873665169 3289.43873665169 1 1 0 2108 1.50568312798388 0.328708331268812 0.774263891141068
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lecorguille
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2484 M352T3052 352.200012207031 352.200012207031 352.200012207031 3051.8278523358 3051.8278523358 3051.8278523358 1 1 0 3475 2.20606692547943 -0.613548475280009 0.614314140504846
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lecorguille
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2485 M352T3605 352.300018310547 352.300018310547 352.300018310547 3604.6624118544 3599.62114816753 3609.70367554127 2 1 1 1450 2.85729941766536 0.613529701195758 0.632697885719333
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lecorguille
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2486 M352T3966 352.300018310547 352.300018310547 352.300018310547 3965.93984918769 3960.55571047621 3971.32398789918 2 1 1 36 1.26462767960698 0.220169898215456 0.84879103683697
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lecorguille
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2487 M352T3085 352.300018310547 352.300018310547 352.300018310547 3084.86792455382 3084.86792455382 3084.86792455382 1 1 0 3523 Inf -1 0.5
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lecorguille
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2488 M352T3541 352.300018310547 352.300018310547 352.300018310547 3540.90357804154 3540.90357804154 3540.90357804154 1 1 0 1958 20.6859720381453 -0.95054802076387 0.51554591287897
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lecorguille
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2489 M352T3848 352.300018310547 352.300018310547 352.300018310547 3848.1304160636 3848.1304160636 3848.1304160636 1 0 1 1375 6.93755829954063 0.847102110543773 0.547967367497491
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lecorguille
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2490 M352T3988 352.300018310547 352.300018310547 352.300018310547 3987.77590186394 3987.77590186394 3987.77590186394 1 1 0 4470 1.05105362475411 0.035190875021174 0.975130999468604
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lecorguille
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2491 M352T3418 352.300018310547 352.300018310547 352.300018310547 3418.24984243102 3418.24984243102 3418.24984243102 1 0 1 866 4.83544928421785 1.7331055208016 0.266745408379589
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lecorguille
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2492 M352T4178 352.300018310547 352.300018310547 352.300018310547 4178.03538845123 4178.03538845123 4178.03538845123 1 0 1 4387 Inf 1 0.5
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lecorguille
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2493 M352T3836 352.399993896484 352.399993896484 352.399993896484 3835.7714296004 3835.7714296004 3835.7714296004 1 1 0 3345 2.55873551875492 -0.567389885403893 0.652805440928831
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2494 M353T3091 352.899993896484 352.899993896484 352.899993896484 3091.18043364918 3091.18043364918 3091.18043364918 1 1 0 5362 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2495 M353T3489 353.100006103516 353.100006103516 353.100006103516 3488.56014760837 3488.56014760837 3488.56014760837 1 1 0 31 1.18899417158677 -0.604400945805716 0.645466487261567
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2496 M353T4140 353.100006103516 353.100006103516 353.100006103516 4139.79880766744 4139.79880766744 4139.79880766744 1 0 1 4217 1.47910074497124 0.495104528875333 0.670911697379948
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2497 M353T2537 353.100006103516 353.100006103516 353.100006103516 2537.271668269 2537.271668269 2537.271668269 1 0 1 234 1.65581277741313 -1.1058137718441 0.392133370386689
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2498 M353T2559 353.100006103516 353.100006103516 353.100006103516 2559.181668269 2559.181668269 2559.181668269 1 0 1 3072 1.37057016659584 -0.218418871356316 0.849014594847183
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2499 M353T3501 353.200012207031 353.200012207031 353.200012207031 3500.93050564996 3500.93050564996 3500.93050564996 1 1 0 3373 2.36990683984523 -0.55955985092038 0.658519318048749
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2500 M353T2684 353.200012207031 353.200012207031 353.200012207031 2684.41329800875 2684.41329800875 2684.41329800875 1 0 1 [M+Cl]- 318.225 6 1.28166150125433 -0.251988027578542 0.831746870718754
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
2501 M353T3484 353.200012207031 353.200012207031 353.200012207031 3484.13394333629 3484.13394333629 3484.13394333629 1 1 0 [M+Cl]- 318.229 [M-H]- 354.211 31 1.6529358274937 -0.337977841977221 0.773514848053641
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
2502 M353T3004 353.200012207031 353.200012207031 353.200012207031 3003.57572061205 3003.57572061205 3003.57572061205 1 0 1 4088 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
2503 M353T4108 353.300018310547 353.300018310547 353.300018310547 4108.07171749863 4108.07171749863 4108.07171749863 1 1 0 2298 3.66114499577849 -0.701176323664824 0.597974241667427
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2504 M353T3611 353.300018310547 353.300018310547 353.300018310547 3610.54864523817 3610.54864523817 3610.54864523817 1 1 0 2582 5.29459236186447 -2.21117038501926 0.184919083067604
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2505 M353T4059 353.300018310547 353.300018310547 353.300018310547 4059.4167690378 4059.4167690378 4059.4167690378 1 0 1 4695 1.7612379183773 0.659032208615214 0.628917435475874
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2506 M353T3265 353.399993896484 353.399993896484 353.399993896484 3264.50139718949 3264.50139718949 3264.50139718949 1 0 1 3603 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2507 M353T3908 353.399993896484 353.399993896484 353.399993896484 3908.04916438552 3908.04916438552 3908.04916438552 1 0 1 4825 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2508 M353T3356 353.399993896484 353.399993896484 353.399993896484 3355.56487489459 3355.56487489459 3355.56487489459 1 0 1 727 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2509 M354T4168 353.899993896484 353.899993896484 353.899993896484 4167.59745309169 4167.59745309169 4167.59745309169 1 1 0 5924 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2510 M354T3272 354 354 354 3271.85845640343 3271.85845640343 3271.85845640343 1 0 1 5012 4.75912023525677 2.02622313060108 0.201865097034421
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2511 M354T3910 354 354 354 3909.96477831024 3909.96477831024 3909.96477831024 1 1 0 4826 1.34427859919274 -0.255920635481155 0.840405169143596
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2512 M354T3973 354 354 354 3973.47763568642 3973.47763568642 3973.47763568642 1 1 0 2027 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
2513 M354T3617 354.200012207031 354.200012207031 354.200012207031 3616.87741637813 3615.49451674551 3618.26031601074 2 2 0 [42][M]- [M-H-C5H8O4]- 487.237 51 7.88629248265958 -9.54025345985108 0.0588188568595389
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2514 M354T2785 354.200012207031 354.200012207031 354.200012207031 2785.14849429222 2785.14849429222 2785.14849429222 1 1 0 12 5.50721791964445 -2.41754341094691 0.15902578560357
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2515 M354T4424 354.200012207031 354.200012207031 354.200012207031 4423.79315089905 4423.79315089905 4423.79315089905 1 0 1 341 7.20547945205438 0.853040788742881 0.546071761243485
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2516 M354T3218 354.300018310547 354.300018310547 354.300018310547 3217.64678465733 3216.27350242875 3219.0200668859 2 0 2 4316 Inf 3.03630728359524 0.202546285925983
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2517 M354T3705 354.300018310547 354.300018310547 354.300018310547 3704.60946684459 3704.60946684459 3704.60946684459 1 1 0 1177 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
2518 M354T4176 354.300018310547 354.300018310547 354.300018310547 4176.48836940693 4176.48836940693 4176.48836940693 1 0 1 4388 15.3102794168653 2.01507264633653 0.285635799774512
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2519 M354T3413 354.300018310547 354.300018310547 354.300018310547 3413.13189907765 3413.13189907765 3413.13189907765 1 1 0 867 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2520 M354T3079 354.300018310547 354.300018310547 354.300018310547 3079.09359645324 3079.09359645324 3079.09359645324 1 1 0 3524 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2521 M354T2586 354.300018310547 354.300018310547 354.300018310547 2585.63897459635 2585.63897459635 2585.63897459635 1 1 0 2888 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2522 M354T3997 354.399993896484 354.399993896484 354.399993896484 3997.30497933253 3997.30497933253 3997.30497933253 1 1 0 5439 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2523 M354T4177 354.399993896484 354.399993896484 354.399993896484 4177.13473042771 4177.13473042771 4177.13473042771 1 1 0 115 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
2524 M355T2725 354.899993896484 354.899993896484 354.899993896484 2725.4962936177 2725.4962936177 2725.4962936177 1 1 0 2476 35.1085366653444 -0.971123048969048 0.509116457523439
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
2525 M355T3492 355 355 355 3492.02433763762 3492.02433763762 3492.02433763762 1 1 0 1789 1.21404802917803 -0.259908662380203 0.820377463113105
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2526 M355T3733 355 355 355 3732.66820646028 3732.66820646028 3732.66820646028 1 0 1 3559 1.72492871387738 0.692452790347971 0.598761911685457
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2527 M355T2821 355 355 355 2821.46649827494 2821.46649827494 2821.46649827494 1 0 1 3294 1.09742158526311 0.0827884975968207 0.944955288423168
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2528 M355T3404 355 355 355 3403.71195310584 3403.71195310584 3403.71195310584 1 1 0 1304 2.47972520305988 -1.15611405989673 0.43763080781886
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2529 M355T3563 355.100006103516 355.100006103516 355.100006103516 3562.68017657503 3562.68017657503 3562.68017657503 1 0 1 1637 1.28207378908787 -0.626527518791987 0.597519216254204
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2530 M355T2881 355.200012207031 355.200012207031 355.200012207031 2880.63943195926 2880.63943195926 2880.63943195926 1 1 0 4730 1.27179326333327 -0.167995952548751 0.882794209631735
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2531 M355T2961 355.200012207031 355.200012207031 355.200012207031 2960.60185152721 2960.60185152721 2960.60185152721 1 0 1 3232 2.24931984272103 0.507524955611613 0.680949149244093
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2532 M355T3618 355.200012207031 355.200012207031 355.200012207031 3618.26031601074 3618.26031601074 3618.26031601074 1 1 0 [42][M+1]- 51 4.69556516957181 -6.95063064880234 0.0891147801967374
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
2533 M355T3997 355.300018310547 355.300018310547 355.300018310547 3996.95215046942 3990.95261859624 4002.95168234261 2 2 0 5435 Inf -9.01568627450941 0.070325001429373
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2534 M355T3731 355.300018310547 355.300018310547 355.300018310547 3731.0908469449 3731.0908469449 3731.0908469449 1 0 1 3560 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2535 M355T3275 355.300018310547 355.300018310547 355.300018310547 3275.12473374223 3275.12473374223 3275.12473374223 1 1 0 5013 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2536 M355T3795 355.300018310547 355.300018310547 355.300018310547 3794.94888137568 3794.94888137568 3794.94888137568 1 1 0 5403 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2537 M355T4114 355.300018310547 355.300018310547 355.300018310547 4114.49205728586 4114.49205728586 4114.49205728586 1 0 1 2299 Inf 3.6059978656345 0.172217023133181
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2538 M356T4061 355.899993896484 355.899993896484 355.899993896484 4061.02290244779 4061.02290244779 4061.02290244779 1 1 0 4696 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2539 M356T3741 356 356 356 3740.56103194088 3740.56103194088 3740.56103194088 1 0 1 1049 Inf 14.7273242160561 0.0431608670100527
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2540 M356T3698 356 356 356 3698.49078265362 3698.49078265362 3698.49078265362 1 1 0 4190 2.88985066889713 -0.618006381044752 0.63081740824119
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2541 M356T3331 356 356 356 3330.81873554805 3330.81873554805 3330.81873554805 1 0 1 1101 3.80216348987355 2.61994726198914 0.154681759033659
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2542 M356T3374 356 356 356 3374.04380803937 3374.04380803937 3374.04380803937 1 0 1 1558 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2543 M356T3055 356 356 356 3054.96586293458 3054.96586293458 3054.96586293458 1 1 0 3489 5.46642585076428 -1.05751341400398 0.480775182246326
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2544 M356T3132 356.100006103516 356.100006103516 356.100006103516 3132.1092416445 3132.1092416445 3132.1092416445 1 0 1 4994 1.1676306622508 -0.198581050529696 0.868857004738393
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2545 M356T3031 356.100006103516 356.100006103516 356.100006103516 3031.46173389346 3031.46173389346 3031.46173389346 1 1 0 [2M-H+Cl]2- 339.11 39 8.05002791455605 -1.07184529346565 0.477929758220284
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2546 M356T3826 356.200012207031 356.200012207031 356.200012207031 3825.97073744502 3821.31525115171 3831.57797680344 4 2 2 [43][M]- 33 5.2176257811783 -2.48033117684177 0.215496578853402
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2547 M356T3857 356.300018310547 356.300018310547 356.300018310547 3856.50094918899 3853.63432582227 3859.36757255571 2 1 1 1376 2.59213640700456 0.646778195676843 0.608492202563681
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2548 M356T4141 356.300018310547 356.300018310547 356.300018310547 4140.97627071899 4140.97627071899 4140.97627071899 1 1 0 4218 4.52310966132655 -0.760547369419065 0.576670418221882
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2549 M356T3813 356.300018310547 356.300018310547 356.300018310547 3812.73620429211 3812.73620429211 3812.73620429211 1 0 1 2383 2.48419076761559 0.638477123036183 0.609947075838414
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2550 M356T4005 356.300018310547 356.300018310547 356.300018310547 4005.24194327753 4005.24194327753 4005.24194327753 1 1 0 5818 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2551 M356T3000 356.300018310547 356.300018310547 356.300018310547 3000.40824664514 3000.40824664514 3000.40824664514 1 0 1 [M+Cl]- 321.336 1822 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2552 M356T3922 356.300018310547 356.300018310547 356.300018310547 3922.2425435536 3922.2425435536 3922.2425435536 1 0 1 2992 1.4738458728195 0.416357341021668 0.745107378968005
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2553 M356T3343 356.399993896484 356.399993896484 356.399993896484 3343.30928447979 3343.30928447979 3343.30928447979 1 1 0 807 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2554 M356T3972 356.399993896484 356.399993896484 356.399993896484 3971.54847467035 3971.54847467035 3971.54847467035 1 1 0 2028 5.4308108661023 -0.813481632193369 0.563967133002875
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2555 M356T4110 356.5 356.5 356.5 4109.63932175949 4109.63932175949 4109.63932175949 1 1 0 2300 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2556 M357T4088 356.800018310547 356.800018310547 356.800018310547 4087.68938648022 4087.68938648022 4087.68938648022 1 1 0 4959 Inf -1 0.5
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lecorguille
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2557 M357T2695 356.899993896484 356.899993896484 356.899993896484 2695.42509544522 2695.42509544522 2695.42509544522 1 1 0 5069 Inf -2.42413598536676 0.249078159058038
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2558 M357T2718 356.899993896484 356.899993896484 356.899993896484 2717.74648766991 2717.74648766991 2717.74648766991 1 1 0 2477 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2559 M357T3897 357 357 357 3897.28967106009 3897.28967106009 3897.28967106009 1 1 0 5754 Inf -6.48048864603838 0.0974676233200404
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2560 M357T3853 357 357 357 3853.06616177411 3853.06616177411 3853.06616177411 1 1 0 1377 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2561 M357T3920 357 357 357 3919.5716518483 3919.5716518483 3919.5716518483 1 0 1 2955 3.19243378401346 2.18344466859635 0.270199020142215
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2562 M357T3732 357 357 357 3731.60167054542 3731.60167054542 3731.60167054542 1 0 1 84 2.00049405385601 0.536647202658973 0.653515616937031
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2563 M357T3218 357 357 357 3217.78886318599 3217.78886318599 3217.78886318599 1 1 0 4317 1.52854929212514 -0.289362563335365 0.803328494110888
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2564 M357T4197 357 357 357 4196.61579820016 4196.61579820016 4196.61579820016 1 0 1 6161 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2565 M357T3190 357 357 357 3189.54369101986 3189.54369101986 3189.54369101986 1 1 0 2189 Inf -1 0.5
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lecorguille
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2566 M357T3283 357 357 357 3282.84018099771 3282.84018099771 3282.84018099771 1 0 1 1242 1.63249099030595 -0.569149850548867 0.62765883897095
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2567 M357T3514 357 357 357 3514.40676681436 3514.40676681436 3514.40676681436 1 0 1 364 2.30890729801298 0.599555113691821 0.626811162982522
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
2568 M357T3465 357.100006103516 357.100006103516 357.100006103516 3465.11864061023 3462.3352029731 3469.95668653736 3 2 1 1271 4.00212453732769 -2.64190255999962 0.154332526468076
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
2569 M357T3497 357.100006103516 357.100006103516 357.100006103516 3496.50654000339 3496.50654000339 3496.50654000339 1 0 1 82 1.13015224248309 -0.124997623176986 0.918529871208122
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
2570 M357T3868 357.100006103516 357.100006103516 357.100006103516 3867.79017666577 3867.79017666577 3867.79017666577 1 0 1 21 1.93518518910848 0.494626284065163 0.687976316319957
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2571 M357T3822 357.200012207031 357.200012207031 357.200012207031 3821.65302052574 3821.65302052574 3830.28845436431 3 2 0 [43][M+1]- 33 4.51758598358791 -2.46030007313345 0.20832895156248
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2572 M357T3471 357.200012207031 357.200012207031 357.200012207031 3470.86800696402 3468.69467784151 3473.04133608654 2 0 2 3104 3.3414640168921 2.40741601444355 0.140310639086765
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2573 M357T2690 357.200012207031 357.200012207031 357.200012207031 2689.88585851541 2689.88585851541 2689.88585851541 1 1 0 650 1.9619886109373 -0.761475509199533 0.53029039545522
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2574 M357T2521 357.200012207031 357.200012207031 357.200012207031 2521.47597459635 2521.47597459635 2521.47597459635 1 1 0 5049 5.25347129405282 -1.05057650800104 0.467957637962605
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2575 M357T2589 357.200012207031 357.200012207031 357.200012207031 2588.76897459635 2588.76897459635 2588.76897459635 1 1 0 2878 Inf -1.62503992045079 0.351187488816888
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2576 M357T3219 357.200012207031 357.200012207031 357.200012207031 3219.25981072202 3219.25981072202 3219.25981072202 1 1 0 4283 Inf -1.17748889834286 0.448223068873697
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2577 M357T3723 357.300018310547 357.300018310547 357.300018310547 3723.46990095085 3723.46990095085 3723.46990095085 1 1 0 3443 Inf -2915.61722357943 0.000218348191338702
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2578 M357T3815 357.300018310547 357.300018310547 357.300018310547 3814.99155790501 3814.99155790501 3814.99155790501 1 0 1 2384 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2579 M357T2760 357.399993896484 357.399993896484 357.399993896484 2759.93600608998 2759.93600608998 2759.93600608998 1 0 1 5491 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2580 M357T4460 357.399993896484 357.399993896484 357.399993896484 4459.78715089905 4459.78715089905 4459.78715089905 1 0 1 335 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2581 M357T3519 357.399993896484 357.399993896484 357.399993896484 3519.03302389935 3519.03302389935 3519.03302389935 1 0 1 361 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2582 M358T2525 357.800018310547 357.800018310547 357.800018310547 2524.752668269 2524.752668269 2524.752668269 1 0 1 5050 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2583 M358T3286 357.800018310547 357.800018310547 357.800018310547 3285.9871617447 3285.9871617447 3285.9871617447 1 0 1 3794 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2584 M358T3313 357.899993896484 357.899993896484 357.899993896484 3313.42537332671 3313.42537332671 3313.42537332671 1 1 0 503 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2585 M358T4056 357.899993896484 357.899993896484 357.899993896484 4056.26458848254 4056.26458848254 4056.26458848254 1 0 1 3423 Inf 1.67959886150133 0.341874816123143
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
2586 M358T2654 357.899993896484 357.899993896484 357.899993896484 2654.32755137323 2654.32755137323 2654.32755137323 1 0 1 5843 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
2587 M358T2854 357.899993896484 357.899993896484 357.899993896484 2854.33877468858 2854.33877468858 2854.33877468858 1 1 0 4257 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2588 M358T4007 357.899993896484 357.899993896484 357.899993896484 4007.3955282255 4007.3955282255 4007.3955282255 1 0 1 5215 2.25494156700603 0.508746840937055 0.680350904835268
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2589 M358T3692 358 358 358 3692.44181750114 3692.44181750114 3692.44181750114 1 0 1 594 2.5429390306544 0.83933318046075 0.502004179619042
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2590 M358T3317 358 358 358 3316.91873178114 3316.91873178114 3316.91873178114 1 0 1 529 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2591 M358T3290 358 358 358 3289.70727378733 3289.70727378733 3289.70727378733 1 1 0 2109 2.81736371500864 -1.47645662353065 0.289731397919792
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2592 M358T3749 358 358 358 3748.75724616318 3748.75724616318 3748.75724616318 1 0 1 1037 11.8834464166721 0.912623731001813 0.527347650899265
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2593 M358T4119 358 358 358 4118.91791660954 4118.91791660954 4118.91791660954 1 1 0 4555 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2594 M358T2776 358.100006103516 358.100006103516 358.100006103516 2775.99698343359 2774.67191534644 2777.32205152075 2 1 1 5132 1.14829759874532 0.266927531235913 0.820940055789417
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2595 M358T3352 358.200012207031 358.200012207031 358.200012207031 3352.41554007478 3352.41554007478 3352.41554007478 1 1 0 7 1.82914015807072 -0.896397223373873 0.525259512298629
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2596 M358T3008 358.200012207031 358.200012207031 358.200012207031 3008.32365642662 3008.32365642662 3008.32365642662 1 0 1 37 1.82534377199066 0.652608002730989 0.631875301985269
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2597 M358T3832 358.200012207031 358.200012207031 358.200012207031 3831.89579609347 3831.89579609347 3831.89579609347 1 1 0 3354 5.70687189414352 -1.25957817941333 0.422309356080053
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2598 M358T2700 358.300018310547 358.300018310547 358.300018310547 2700.09391966008 2700.09391966008 2700.09391966008 1 1 0 4868 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2599 M358T3822 358.300018310547 358.300018310547 358.300018310547 3821.65302052574 3821.65302052574 3821.65302052574 1 1 0 33 12.6518681428472 -0.918096951702388 0.525643950942037
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2600 M358T3959 358.300018310547 358.300018310547 358.300018310547 3958.76909576651 3958.76909576651 3958.76909576651 1 0 1 173 1.19067840782278 -0.189001022018701 0.880259641887894
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2601 M359T4121 358.899993896484 358.899993896484 358.899993896484 4120.87908209639 4120.87908209639 4120.87908209639 1 0 1 1720 Inf 1 0.5
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lecorguille
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2602 M359T4144 358.899993896484 358.899993896484 358.899993896484 4144.11906198033 4144.11906198033 4144.11906198033 1 1 0 5829 Inf -1 0.5
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lecorguille
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2603 M359T2924 358.899993896484 358.899993896484 358.899993896484 2923.6821033927 2923.6821033927 2923.6821033927 1 1 0 [M-H-C3H2O3]- 445.911 60 Inf -1 0.5
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lecorguille
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2604 M359T3962 358.899993896484 358.899993896484 358.899993896484 3962.12613457543 3962.12613457543 3962.12613457543 1 1 0 6132 6.41237077740735 -1.08053482810798 0.464333509683999
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2605 M359T3500 359 359 359 3500.25024217151 3496.75308645138 3502.11662938801 4 2 2 [M-H-C6H8O6]- 536.034 76 1.70962331393051 1.40076676248778 0.356593176880365
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
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2606 M359T3221 359 359 359 3221.02178189128 3221.02178189128 3221.02178189128 1 0 1 4318 3.12642677889728 -0.86241168876221 0.512303371025185
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lecorguille
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2607 M359T3732 359.100006103516 359.100006103516 359.100006103516 3732.37889703138 3732.37889703138 3732.37889703138 1 1 0 3561 2.79187295785124 0.803594186764491 0.530673108335361
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2608 M359T3712 359.200012207031 359.200012207031 359.200012207031 3711.67368554629 3704.36614312564 3719.10248465668 4 2 2 17 1.02154726652486 0.0527219439691536 0.964283990382539
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2609 M359T2644 359.200012207031 359.200012207031 359.200012207031 2644.46562016774 2644.46562016774 2644.46562016774 1 1 0 5652 1.02777893156644 0.0193717645346255 0.986304547689281
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2610 M359T2722 359.200012207031 359.200012207031 359.200012207031 2721.6897701577 2721.6897701577 2721.6897701577 1 0 1 2478 2.29338788160569 -0.516957125827795 0.676357012638615
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2611 M359T2755 359.200012207031 359.200012207031 359.200012207031 2755.4928649888 2755.4928649888 2755.4928649888 1 0 1 218 1.59762232010143 -0.317077961288047 0.786170119076937
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2612 M359T3377 359.300018310547 359.300018310547 359.300018310547 3377.15027106342 3377.15027106342 3377.15027106342 1 1 0 1559 3.12404396630169 -0.647536741805471 0.618712073269384
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2613 M359T3363 359.300018310547 359.300018310547 359.300018310547 3362.60595783274 3362.60595783274 3362.60595783274 1 0 1 4655 Inf 1 0.5
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2614 M359T4022 359.300018310547 359.300018310547 359.300018310547 4021.58543048651 4021.58543048651 4021.58543048651 1 0 1 5573 15.0739322108043 3.11431672384578 0.17880104926518
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2615 M359T4047 359.300018310547 359.300018310547 359.300018310547 4046.80737474064 4046.80737474064 4046.80737474064 1 0 1 4113 Inf 1 0.5
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2616 M359T3182 359.300018310547 359.300018310547 359.300018310547 3181.52334306993 3181.52334306993 3181.52334306993 1 0 1 2190 1.0880946221314 -0.0596112269357299 0.957919922022261
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2617 M359T3158 359.300018310547 359.300018310547 359.300018310547 3158.12108870158 3158.12108870158 3158.12108870158 1 0 1 830 5.92659830126271 0.819682805741469 0.556822431813777
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2618 M359T3420 359.300018310547 359.300018310547 359.300018310547 3419.8303405743 3419.8303405743 3419.8303405743 1 0 1 868 Inf 1 0.5
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2619 M359T4124 359.399993896484 359.399993896484 359.399993896484 4124.0320044962 4124.0320044962 4124.0320044962 1 0 1 1721 Inf 1 0.5
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lecorguille
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2620 M360T2632 359.899993896484 359.899993896484 359.899993896484 2632.16386004811 2632.16386004811 2632.16386004811 1 0 1 2644 2.07659420851572 0.467103425338039 0.70130468445736
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lecorguille
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2621 M360T3962 359.899993896484 359.899993896484 359.899993896484 3961.66776334958 3961.66776334958 3961.66776334958 1 0 1 6133 1.01752859085065 0.0122864357330026 0.991312804062171
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lecorguille
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2623 M360T2661 360 360 360 2660.65986778842 2660.65986778842 2660.65986778842 1 0 1 42 1.17865687454294 2.77222272821043 0.21955905937779
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lecorguille
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2625 M360T3363 360 360 360 3362.60595783274 3362.60595783274 3362.60595783274 1 0 1 4656 1.91109062523803 0.649445877569806 0.621630318614504
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lecorguille
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lecorguille
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2628 M360T4128 360.200012207031 360.200012207031 360.200012207031 4128.36599789849 4128.36599789849 4128.36599789849 1 1 0 23 2.17348491896695 -0.755564150753975 0.583175502840299
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lecorguille
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2630 M360T3003 360.200012207031 360.200012207031 360.200012207031 3002.51550249204 3002.51550249204 3002.51550249204 1 0 1 4089 Inf 1 0.5
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lecorguille
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2631 M360T4151 360.300018310547 360.300018310547 360.300018310547 4150.84085356425 4150.84085356425 4150.84085356425 1 0 1 6042 Inf 1 0.5
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lecorguille
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2632 M360T3393 360.300018310547 360.300018310547 360.300018310547 3392.82907241035 3392.82907241035 3392.82907241035 1 1 0 479 5.62699489282812 -0.809600018069749 0.560127423560331
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lecorguille
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2633 M360T3374 360.300018310547 360.300018310547 360.300018310547 3373.76860478077 3373.76860478077 3373.76860478077 1 0 1 1560 Inf 1 0.5
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lecorguille
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2634 M360T3161 360.300018310547 360.300018310547 360.300018310547 3161.37833400712 3161.37833400712 3161.37833400712 1 1 0 10 Inf -1 0.5
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lecorguille
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2635 M361T2931 360.899993896484 360.899993896484 360.899993896484 2931.44923608861 2931.44923608861 2931.44923608861 1 1 0 86 Inf -1 0.5
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lecorguille
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2636 M361T3758 360.899993896484 360.899993896484 360.899993896484 3757.96083418913 3757.96083418913 3757.96083418913 1 0 1 980 Inf 1 0.5
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lecorguille
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2637 M361T3889 361 361 361 3888.8407869238 3888.8407869238 3888.8407869238 1 1 0 2234 Inf -1 0.5
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lecorguille
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2638 M361T2688 361 361 361 2688.32459589356 2688.32459589356 2688.32459589356 1 1 0 [44][M+1]- 6 2.31914093677903 -1.54243191321711 0.36617180118399
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2639 M361T3500 361 361 361 3499.90373818767 3499.90373818767 3499.90373818767 1 1 0 3374 Inf -43.9400119962222 0.0144858835321275
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lecorguille
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2640 M361T3875 361 361 361 3874.93416020634 3874.93416020634 3874.93416020634 1 0 1 2741 Inf 1 0.5
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lecorguille
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2641 M361T3429 361 361 361 3428.5072600218 3428.5072600218 3428.5072600218 1 1 0 5264 Inf -1.86841539027368 0.312847374314966
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2642 M361T2961 361 361 361 2961.0658245432 2961.0658245432 2961.0658245432 1 1 0 3235 128.989193828452 -1.04893791851322 0.48477903320825
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lecorguille
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2643 M361T3538 361 361 361 3537.63189084738 3537.63189084738 3537.63189084738 1 0 1 1960 Inf 3.4487268411309 0.179668386215665
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lecorguille
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2644 M361T3467 361 361 361 3466.70874766651 3466.70874766651 3466.70874766651 1 1 0 3105 4.10148011509076 -1.3511794158048 0.349970303928905
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lecorguille
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2645 M361T3171 361.100006103516 361.100006103516 361.100006103516 3170.60083826976 3167.07809896551 3177.02861464035 3 1 2 757 1.32460261516529 0.961251932642169 0.509670891370346
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lecorguille
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2646 M361T3149 361.100006103516 361.100006103516 361.100006103516 3148.73119452649 3136.79355851779 3148.84846331748 3 2 1 3053 2.04106709503539 -2.36114998709695 0.145652658953173
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lecorguille
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2647 M361T2686 361.100006103516 361.100006103516 361.100006103516 2685.99762320992 2684.41329800875 2687.58194841108 2 1 1 6 1.82332356226485 1.13379029277156 0.459282727701859
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2648 M361T3853 361.100006103516 361.100006103516 361.100006103516 3852.86036818393 3852.86036818393 3852.86036818393 1 0 1 [45][M]- [M-H]- 362.106 [M-H-NH3]- 379.133 21 1.38640315399112 1.21806509992372 0.353098791497675
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2649 M361T2864 361.100006103516 361.100006103516 361.100006103516 2863.66189187661 2863.66189187661 2863.66189187661 1 1 0 3643 1.02452621155883 0.0198599678042406 0.986111124252017
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2650 M361T4206 361.100006103516 361.100006103516 361.100006103516 4206.08869342051 4206.08869342051 4206.08869342051 1 0 1 4929 1.01941860391579 0.0571425547120132 0.96123836585659
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lecorguille
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2651 M361T3160 361.200012207031 361.200012207031 361.200012207031 3159.74716603341 3159.68170812797 3159.81262393884 2 1 1 10 1.01519485908353 -0.0184150370584192 0.987330708886069
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2652 M361T2826 361.200012207031 361.200012207031 361.200012207031 2825.77378996252 2825.77378996252 2825.77378996252 1 1 0 4577 1.70464598673298 -0.396003085399168 0.751842839725208
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2653 M361T4111 361.200012207031 361.200012207031 361.200012207031 4111.04941480277 4111.04941480277 4111.04941480277 1 1 0 2301 4.08470073583915 -0.826143097866359 0.544980677248987
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lecorguille
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2654 M361T3331 361.200012207031 361.200012207031 361.200012207031 3330.76303444643 3330.76303444643 3330.76303444643 1 1 0 1102 2.02179897269187 -0.626312610620241 0.631110329056911
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2655 M361T3959 361.200012207031 361.200012207031 361.200012207031 3958.76909576651 3958.76909576651 3958.76909576651 1 0 1 5455 Inf 1 0.5
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lecorguille
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2656 M361T3791 361.200012207031 361.200012207031 361.200012207031 3790.84576766149 3790.84576766149 3790.84576766149 1 0 1 4446 3.73702744233556 0.780965330868034 0.576276801813594
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2657 M361T3537 361.300018310547 361.300018310547 361.300018310547 3537.00937746372 3537.00937746372 3537.00937746372 1 0 1 1961 2.39840957311252 0.686648593714442 0.579171053460584
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2658 M361T3987 361.300018310547 361.300018310547 361.300018310547 3987.25038756978 3987.25038756978 3987.25038756978 1 1 0 4471 5.28466517287381 -1.44139565804818 0.349742903803356
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2659 M361T3967 361.300018310547 361.300018310547 361.300018310547 3966.837351156 3966.837351156 3966.837351156 1 1 0 2029 Inf -1 0.5
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lecorguille
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2660 M361T3611 361.300018310547 361.300018310547 361.300018310547 3610.7819297687 3610.7819297687 3610.7819297687 1 1 0 2583 11.437285806619 -0.909098443022802 0.528445681565081
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2661 M362T4141 361.899993896484 361.899993896484 361.899993896484 4140.97627071899 4140.97627071899 4140.97627071899 1 1 0 110 5.39471707155698 -1.19097164648193 0.423167872274566
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2662 M362T2697 362 362 362 2697.10629142878 2697.09529149161 2697.11729136595 2 0 2 148 1.25976282454156 1.03868735305823 0.409593882314434
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lecorguille
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lecorguille
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2664 M362T3723 362 362 362 3723.2119601311 3723.2119601311 3723.2119601311 1 0 1 3434 1.96486398134267 -0.437640103018924 0.716831194120305
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lecorguille
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2665 M362T3550 362 362 362 3550.41961653011 3550.41961653011 3550.41961653011 1 1 0 2339 5.08239200642863 -0.788131406925233 0.567266442476368
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lecorguille
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2666 M362T3823 362 362 362 3823.22242960042 3823.22242960042 3823.22242960042 1 1 0 1852 2.19280018691664 -0.494926219939969 0.687175975778664
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lecorguille
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2667 M362T2684 362.100006103516 362.100006103516 362.100006103516 2683.62713632746 2681.24264064001 2685.68075810517 3 1 2 [M-H]- 363.113 6 1.44810899666653 -0.623450207109212 0.596669675208727
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
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2668 M362T3854 362.100006103516 362.100006103516 362.100006103516 3854.43704990612 3854.43704990612 3854.43704990612 1 0 1 [45][M+1]- 21 1.0977382519083 -0.0831713215442708 0.942148506010036
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lecorguille
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2669 M362T3154 362.100006103516 362.100006103516 362.100006103516 3153.54363378706 3153.54363378706 3153.54363378706 1 1 0 3029 1.39304917123602 -1.85090458600702 0.291396128180755
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2670 M362T4113 362.200012207031 362.200012207031 362.200012207031 4112.62286095321 4112.62286095321 4112.62286095321 1 1 0 [M-H]- 363.207 [M-H-C2H4]- 391.233 43 1.81253584164557 -0.49776478580512 0.688463735481202
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2671 M362T3845 362.200012207031 362.200012207031 362.200012207031 3844.97719520822 3844.97719520822 3844.97719520822 1 0 1 [M-H-C2H4]- 391.234 21 1.40311992909065 0.461420047898077 0.719304519257327
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
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2672 M362T2845 362.200012207031 362.200012207031 362.200012207031 2845.06971747967 2845.06971747967 2845.06971747967 1 0 1 181 42.6495288360183 1.120578708076 0.463630242307135
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2673 M362T4164 362.200012207031 362.200012207031 362.200012207031 4164.46634710896 4164.46634710896 4164.46634710896 1 1 0 285 Inf -1 0.5
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2674 M362T2954 362.200012207031 362.200012207031 362.200012207031 2954.42138689764 2954.42138689764 2954.42138689764 1 0 1 3184 14.9775949692411 0.931160473360563 0.521580352298461
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lecorguille
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2675 M362T3484 362.300018310547 362.300018310547 362.300018310547 3484.13394333629 3484.13394333629 3484.13394333629 1 1 0 1790 Inf -1 0.5
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lecorguille
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2676 M362T4108 362.300018310547 362.300018310547 362.300018310547 4108.07171749863 4108.07171749863 4108.07171749863 1 1 0 2302 2.39991594460474 -0.538445277787648 0.666116973687176
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lecorguille
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2677 M362T3648 362.300018310547 362.300018310547 362.300018310547 3648.20797931774 3648.20797931774 3648.20797931774 1 0 1 1534 Inf 2.59900424292819 0.233831840314188
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lecorguille
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2678 M362T3581 362.300018310547 362.300018310547 362.300018310547 3580.59682162642 3580.59682162642 3580.59682162642 1 1 0 1664 4.7461874954857 -0.772347479912105 0.572613323174794
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2679 M362T2805 362.300018310547 362.300018310547 362.300018310547 2804.56537064767 2804.56537064767 2804.56537064767 1 0 1 5183 Inf 1 0.5
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lecorguille
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2680 M362T3843 362.300018310547 362.300018310547 362.300018310547 3842.6100321328 3842.6100321328 3842.6100321328 1 0 1 21 2.99747633736991 0.808231688845193 0.563204969535687
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lecorguille
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2681 M362T3394 362.300018310547 362.300018310547 362.300018310547 3394.46678522768 3394.46678522768 3394.46678522768 1 0 1 502 5.68187621664636 0.820605943087116 0.56070965170295
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lecorguille
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2682 M362T3456 362.300018310547 362.300018310547 362.300018310547 3455.56264424004 3455.56264424004 3455.56264424004 1 1 0 19 2.24163318834299 -0.79813067687132 0.545698696637655
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lecorguille
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2683 M362T3823 362.399993896484 362.399993896484 362.399993896484 3823.22242960042 3823.22242960042 3823.22242960042 1 1 0 1881 Inf -1 0.5
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lecorguille
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2684 M363T2605 362.899993896484 362.899993896484 362.899993896484 2604.56463067859 2598.45128676082 2610.67797459635 2 2 0 5245 Inf -2.33108480152729 0.257984420865679
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lecorguille
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2685 M363T2753 362.899993896484 362.899993896484 362.899993896484 2752.75759132145 2752.75759132145 2752.75759132145 1 1 0 114 Inf -1 0.5
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lecorguille
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2686 M363T3890 363 363 363 3889.77519285019 3889.77519285019 3889.77519285019 1 0 1 2235 3.96336384931744 0.724969034638127 0.589246318245059
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lecorguille
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2687 M363T2867 363 363 363 2867.40119261922 2867.40119261922 2867.40119261922 1 1 0 3644 8.72586951599293 -1.11528380485358 0.459373775347611
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lecorguille
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2688 M363T3399 363 363 363 3398.67032277783 3398.67032277783 3398.67032277783 1 0 1 480 1.35968659899106 -0.312538425527442 0.790783326753087
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lecorguille
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2689 M363T3819 363 363 363 3819.03452474863 3819.03452474863 3819.03452474863 1 1 0 1882 2.7726958597684 -1.18063145977797 0.360447423690435
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lecorguille
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2690 M363T3253 363.100006103516 363.100006103516 363.100006103516 3253.01613189684 3251.69255120422 3254.33971258947 2 2 0 [M+Cl]- 328.128 34 3.46675057007891 -3.3172921599795 0.182973621128416
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2691 M363T2730 363.100006103516 363.100006103516 363.100006103516 2730.17055423377 2730.17055423377 2730.17055423377 1 1 0 2479 3.72787653233396 -0.823805349274661 0.561231590946511
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lecorguille
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2692 M363T3259 363.200012207031 363.200012207031 363.200012207031 3258.68653659531 3246.33080440992 3261.18345621756 4 2 2 3591 2.14052297281262 4.30400317140389 0.117222632171159
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lecorguille
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2693 M363T2619 363.200012207031 363.200012207031 363.200012207031 2618.50297459635 2618.50297459635 2618.50297459635 1 1 0 2645 Inf -1 0.5
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lecorguille
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2694 M363T2726 363.200012207031 363.200012207031 363.200012207031 2726.48521210177 2726.48521210177 2726.48521210177 1 0 1 2480 4.83527731749759 0.776749087970549 0.57111332867579
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2695 M363T4061 363.300018310547 363.300018310547 363.300018310547 4060.84571909799 4060.66853574818 4061.02290244779 2 2 0 129 9.01414762957738 -4.40093018099301 0.0620490500006681
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lecorguille
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2696 M363T3061 363.300018310547 363.300018310547 363.300018310547 3060.62586790248 3060.62586790248 3060.62586790248 1 1 0 5410 Inf -1 0.5
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lecorguille
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2697 M363T3105 363.300018310547 363.300018310547 363.300018310547 3105.27159141681 3105.27159141681 3105.27159141681 1 0 1 68 Inf 1 0.5
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lecorguille
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2698 M363T3877 363.399993896484 363.399993896484 363.399993896484 3876.72559155354 3876.72559155354 3876.72559155354 1 1 0 2742 Inf -1 0.5
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lecorguille
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2699 M364T2552 363.800018310547 363.800018310547 363.800018310547 2552.20708488001 2552.20708488001 2552.20708488001 1 0 1 3073 Inf 1 0.5
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lecorguille
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2700 M364T4128 363.899993896484 363.899993896484 363.899993896484 4128.36599789849 4128.36599789849 4128.36599789849 1 1 0 1485 Inf -1 0.5
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lecorguille
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2701 M364T2918 363.899993896484 363.899993896484 363.899993896484 2917.50807882371 2917.50807882371 2917.50807882371 1 1 0 [M+Cl]- 328.936 56 Inf -1 0.5
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2702 M364T3343 363.899993896484 363.899993896484 363.899993896484 3343.45213808074 3343.45213808074 3343.45213808074 1 0 1 808 Inf 1 0.5
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2703 M364T3096 364 364 364 3095.9153929194 3095.9153929194 3095.9153929194 1 1 0 5363 4.26983167271344 -0.764837521179067 0.583812760584351
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2704 M364T2949 364 364 364 2948.57935029677 2948.57935029677 2948.57935029677 1 1 0 3177 Inf -1 0.5
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lecorguille
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2705 M364T3302 364 364 364 3302.10240780312 3302.10240780312 3302.10240780312 1 1 0 167 Inf -1 0.5
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lecorguille
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2706 M364T3028 364 364 364 3028.28901291088 3028.28901291088 3028.28901291088 1 1 0 2143 11.5642949858538 -9.87971256535983 0.0364160849037281
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lecorguille
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2707 M364T3218 364 364 364 3217.78886318599 3217.78886318599 3217.78886318599 1 1 0 4284 3.98698697821293 -1.37511547639842 0.338695031700569
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lecorguille
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2708 M364T3159 364 364 364 3159.12807532365 3159.12807532365 3159.12807532365 1 0 1 831 Inf 1 0.5
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lecorguille
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2709 M364T3810 364 364 364 3810.24521108022 3810.24521108022 3810.24521108022 1 0 1 2385 Inf 1 0.5
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lecorguille
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2710 M364T3262 364.100006103516 364.100006103516 364.100006103516 3261.85567942525 3259.79261031675 3263.91874853375 2 0 2 79 1.46084282401037 1.52655535421512 0.266449759603912
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lecorguille
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2711 M364T3723 364.200012207031 364.200012207031 364.200012207031 3723.45563022742 3716.91929635642 3728.16712543704 4 2 2 3435 1.97017480647129 9.06681958131047 0.0594434703496662
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lecorguille
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2712 M364T3686 364.200012207031 364.200012207031 364.200012207031 3686.31999191776 3685.63308733696 3690.86797846772 3 1 2 5 1.00679899118591 -0.0258341888993759 0.98304473536831
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lecorguille
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2713 M364T3250 364.200012207031 364.200012207031 364.200012207031 3250.37421019573 3250.37421019573 3250.37421019573 1 0 1 [M+Cl]- 329.226 34 1.15403439888305 2.0692959502038 0.255040464832343
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lecorguille
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2714 M364T2570 364.200012207031 364.200012207031 364.200012207031 2570.28228676082 2570.28228676082 2570.28228676082 1 1 0 5294 1.1900273437884 -0.12225110582526 0.914169114598487
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lecorguille
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2715 M364T4428 364.200012207031 364.200012207031 364.200012207031 4427.81974443202 4427.81974443202 4427.81974443202 1 0 1 292 Inf 1 0.5
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lecorguille
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2716 M364T3732 364.300018310547 364.300018310547 364.300018310547 3732.37889703138 3732.37889703138 3732.37889703138 1 1 0 3562 Inf -1 0.5
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lecorguille
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2717 M364T3234 364.300018310547 364.300018310547 364.300018310547 3233.59458434886 3233.59458434886 3233.59458434886 1 1 0 2713 3.78645027068153 -1.02344506556718 0.489450402063183
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lecorguille
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2718 M364T3356 364.300018310547 364.300018310547 364.300018310547 3355.52662774881 3355.52662774881 3355.52662774881 1 1 0 708 1.1856660773348 0.136620947504636 0.903918198279141
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lecorguille
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2719 M364T3976 364.300018310547 364.300018310547 364.300018310547 3975.85959815996 3975.85959815996 3975.85959815996 1 0 1 2030 2.49484968936661 0.696412055213805 0.57741255572686
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lecorguille
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2720 M364T3506 364.300018310547 364.300018310547 364.300018310547 3506.21154706686 3506.21154706686 3506.21154706686 1 1 0 3375 Inf -1.46048814163721 0.382217147119155
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lecorguille
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2721 M364T4202 364.300018310547 364.300018310547 364.300018310547 4202.03128531258 4202.03128531258 4202.03128531258 1 1 0 5699 1.44887522483622 -0.254975276968772 0.825174969646473
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2722 M364T4011 364.300018310547 364.300018310547 364.300018310547 4010.80158041945 4010.80158041945 4010.80158041945 1 1 0 156 1.19893561939033 -0.329925711466094 0.794496852075816
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lecorguille
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2723 M365T3323 364.899993896484 364.899993896484 364.899993896484 3323.09295092531 3323.09295092531 3323.09295092531 1 0 1 1145 2.96825299550007 0.628397976573385 0.626498873380327
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lecorguille
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2724 M365T3342 364.899993896484 364.899993896484 364.899993896484 3341.85388514172 3341.85388514172 3341.85388514172 1 0 1 809 Inf 1 0.5
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lecorguille
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2725 M365T2938 364.899993896484 364.899993896484 364.899993896484 2938.44920380841 2938.44920380841 2938.44920380841 1 1 0 2805 Inf -1 0.5
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lecorguille
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2726 M365T2683 365 365 365 2682.6404665213 2681.24264064001 2683.62713632746 4 2 2 [46][M]- [M-2H+Na]- 344.012 6 1.11057584302386 -0.881426783831607 0.533222429064194
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2727 M365T2662 365 365 365 2662.24329763045 2662.07186957376 2663.15465360037 3 1 2 [47][M]- 42 1.12508869435155 -1.28782640625141 0.411165261156554
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2728 M365T4121 365 365 365 4120.87908209639 4120.87908209639 4120.87908209639 1 0 1 1722 Inf 1 0.5
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2729 M365T3540 365 365 365 3540.14981881787 3540.14981881787 3540.14981881787 1 0 1 1962 1.45201974941398 0.256384437422948 0.824268250413939
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2730 M365T3479 365 365 365 3479.26364771539 3479.26364771539 3479.26364771539 1 1 0 1791 Inf -1 0.5
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2731 M365T3647 365 365 365 3646.64773058066 3646.64773058066 3646.64773058066 1 1 0 1524 Inf -1 0.5
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lecorguille
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2732 M365T2593 365 365 365 2593.46397459635 2593.46397459635 2593.46397459635 1 1 0 61 1.11413517985561 -1.07497200806239 0.398562101538855
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lecorguille
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2733 M365T3811 365 365 365 3811.16973221054 3811.16973221054 3811.16973221054 1 0 1 2386 Inf 1 0.5
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lecorguille
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2734 M365T3774 365 365 365 3773.69045671917 3773.69045671917 3773.69045671917 1 0 1 13 Inf 1 0.5
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2735 M365T3247 365 365 365 3247.23300850549 3247.23300850549 3247.23300850549 1 0 1 34 6.27777436804239 0.830240606903341 0.553391208417447
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lecorguille
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2736 M365T2522 365.100006103516 365.100006103516 365.100006103516 2521.622668269 2521.622668269 2521.622668269 1 0 1 147 2.26976471687849 1.26970549702792 0.424675061319814
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2737 M365T4127 365.100006103516 365.100006103516 365.100006103516 4126.89956529202 4126.89956529202 4126.89956529202 1 0 1 1486 14.8997965174392 1.00337771359771 0.497545887003657
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2738 M365T2547 365.100006103516 365.100006103516 365.100006103516 2546.661668269 2546.661668269 2546.661668269 1 0 1 5160 4.98204081632665 3.18532059448885 0.0947548381737184
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lecorguille
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2739 M365T3385 365.100006103516 365.100006103516 365.100006103516 3385.10279838529 3385.10279838529 3385.10279838529 1 1 0 [M-H-CH4]- 382.134 25 15.3995083515965 -2.40039923461562 0.240345185330857
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2740 M365T3373 365.200012207031 365.200012207031 365.200012207031 3372.77706664296 3372.77706664296 3372.77706664296 1 1 0 25 1.70511771124376 -1.07690640494593 0.394214478699273
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2741 M365T3388 365.200012207031 365.200012207031 365.200012207031 3387.88917276548 3387.88917276548 3387.88917276548 1 0 1 3 2.41767408962983 3.31761909555221 0.181108234920303
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2742 M365T3169 365.200012207031 365.200012207031 365.200012207031 3168.66779925792 3168.66779925792 3168.66779925792 1 0 1 8 1.96026971332377 0.436366458655259 0.71751538486111
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2743 M365T3325 365.300018310547 365.300018310547 365.300018310547 3324.63629404843 3324.63629404843 3324.63629404843 1 0 1 1103 Inf 1 0.5
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lecorguille
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diff changeset
2744 M365T4138 365.300018310547 365.300018310547 365.300018310547 4137.75932905108 4137.75932905108 4137.75932905108 1 0 1 3972 3.55326685565427 0.69169830434119 0.601528134597446
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2745 M365T3905 365.399993896484 365.399993896484 365.399993896484 3905.20958329281 3905.20958329281 3905.20958329281 1 1 0 4827 4.12304222937345 -0.736118802417202 0.585246676481605
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2746 M365T3927 365.399993896484 365.399993896484 365.399993896484 3927.40977769388 3927.40977769388 3927.40977769388 1 0 1 2947 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2747 M366T4468 365.899993896484 365.899993896484 365.899993896484 4468.39822276304 4468.39822276304 4468.39822276304 1 1 0 294 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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2748 M366T3321 365.899993896484 365.899993896484 365.899993896484 3321.19223292142 3321.19223292142 3321.19223292142 1 0 1 1131 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2749 M366T4141 365.899993896484 365.899993896484 365.899993896484 4140.96996477634 4140.96996477634 4140.96996477634 1 1 0 4219 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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2750 M366T4118 365.899993896484 365.899993896484 365.899993896484 4117.72633782937 4117.72633782937 4117.72633782937 1 0 1 4556 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2751 M366T4070 365.899993896484 365.899993896484 365.899993896484 4070.44866369949 4070.44866369949 4070.44866369949 1 0 1 3880 2.29460198462379 0.517212317181683 0.676233597400284
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
2752 M366T2683 366 366 366 2683.22747285256 2682.82633158321 2685.68075810517 4 2 2 [46][M+1]- 6 1.25309136075103 -0.969154077419125 0.509087359367865
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2753 M366T2662 366 366 366 2662.32362548878 2661.5564698857 2663.09078109186 2 1 1 [47][M+1]- 42 1.11939235003341 -0.741171546976143 0.593930795800137
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2754 M366T3772 366 366 366 3772.13186127025 3772.13186127025 3772.13186127025 1 0 1 981 8.11406095859071 3.1400971583083 0.129908427654928
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2755 M366T3813 366 366 366 3812.60482106373 3812.60482106373 3812.60482106373 1 1 0 2387 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
2756 M366T3195 366 366 366 3195.03213164613 3195.03213164613 3195.03213164613 1 1 0 1753 Inf -3.08700072625759 0.199435138385167
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2757 M366T3444 366 366 366 3443.74800097262 3443.74800097262 3443.74800097262 1 0 1 2925 1.82775571669254 0.397303833363879 0.739015309933792
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2758 M366T2751 366.100006103516 366.100006103516 366.100006103516 2751.39408484474 2750.03057836802 2752.75759132145 2 1 1 [M-H]- 367.11 114 1.22837444655156 -0.89294363235338 0.528050527656226
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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2759 M366T2787 366.100006103516 366.100006103516 366.100006103516 2787.1832988222 2786.90521866559 2787.4613789788 2 1 1 [M-H]- 367.108 12 1.45580993987311 -1.68088382689136 0.281962169642781
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2760 M366T3854 366.100006103516 366.100006103516 366.100006103516 3854.43704990612 3854.43704990612 3854.43704990612 1 0 1 21 1.02808836864725 -0.0228398329456342 0.983963815254184
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2761 M366T3846 366.200012207031 366.200012207031 366.200012207031 3845.76535702109 3841.8240416177 3850.48570461646 4 2 2 21 1.00670570702571 0.0283707169452747 0.980116235246812
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2762 M366T3937 366.200012207031 366.200012207031 366.200012207031 3936.81565274677 3936.81565274677 3936.81565274677 1 0 1 4147 16.1477745861348 6.8088225058635 0.0432476480386224
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2763 M366T3377 366.200012207031 366.200012207031 366.200012207031 3377.15027106342 3377.15027106342 3377.15027106342 1 1 0 25 1.24451318327577 -2.34392229946885 0.143777937522573
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2764 M366T3146 366.200012207031 366.200012207031 366.200012207031 3146.13816516469 3146.13816516469 3146.13816516469 1 1 0 3029 4.34132331399129 -0.922848813915477 0.507377975684758
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2765 M366T3836 366.300018310547 366.300018310547 366.300018310547 3836.04942689469 3831.06508336713 3841.03377042226 2 1 1 75 1.01734974881325 0.0169670519881497 0.989157302905169
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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2766 M366T3728 366.300018310547 366.300018310547 366.300018310547 3728.47899635669 3728.47899635669 3728.47899635669 1 0 1 3563 3.28026271882301 0.664934620386891 0.611815441606289
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2767 M366T4465 366.300018310547 366.300018310547 366.300018310547 4465.26822276304 4465.26822276304 4465.26822276304 1 1 0 6236 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2768 M366T4072 366.300018310547 366.300018310547 366.300018310547 4072.02357232199 4072.02357232199 4072.02357232199 1 0 1 3881 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2769 M366T3539 366.300018310547 366.300018310547 366.300018310547 3539.3198539101 3539.3198539101 3539.3198539101 1 1 0 1963 4.93540589303664 -0.781501924690537 0.56950149205211
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2770 M366T3866 366.300018310547 366.300018310547 366.300018310547 3866.2182717773 3866.2182717773 3866.2182717773 1 0 1 1378 3.43553594834618 0.680675696530632 0.605719014237457
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2771 M366T3412 366.300018310547 366.300018310547 366.300018310547 3411.55546030634 3411.55546030634 3411.55546030634 1 1 0 11 1.86617201365058 -0.461711831060467 0.723361522083963
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2772 M367T4472 366.899993896484 366.899993896484 366.899993896484 4472.30715089905 4472.30715089905 4472.30715089905 1 0 1 6098 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2773 M367T4407 366.899993896484 366.899993896484 366.899993896484 4406.57915089905 4406.57915089905 4406.57915089905 1 0 1 6173 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2774 M367T3109 367 367 367 3108.53493396828 3108.53493396828 3108.53493396828 1 1 0 3135 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2775 M367T2688 367 367 367 2688.32459589356 2688.32459589356 2688.32459589356 1 1 0 [46][M+2]- 6 1.27978204934653 -0.935418817333512 0.521150483636883
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2776 M367T2665 367 367 367 2664.67742188304 2664.67742188304 2664.67742188304 1 1 0 [47][M+2]- 2261 1.2950620260802 -0.58877017233253 0.652570843672083
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2777 M367T3058 367 367 367 3057.5486695636 3057.5486695636 3057.5486695636 1 1 0 215 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2778 M367T3148 367 367 367 3147.9949574047 3147.9949574047 3147.9949574047 1 0 1 3036 1.78825815872616 0.384728292115772 0.746146119739956
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2779 M367T3355 367 367 367 3354.62837029494 3354.62837029494 3354.62837029494 1 0 1 728 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2780 M367T4287 367.100006103516 367.100006103516 367.100006103516 4286.54540158956 4286.54540158956 4286.54540158956 1 1 0 6093 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2781 M367T3522 367.200012207031 367.200012207031 367.200012207031 3522.09733373219 3518.81181544796 3523.66846363941 4 2 2 [48][M]- 1 1.13405151008924 1.52323395129669 0.361687015304933
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2782 M367T2937 367.200012207031 367.200012207031 367.200012207031 2937.3241056961 2937.3241056961 2937.3241056961 1 0 1 2806 1.85580288300605 0.492163697919355 0.676161494091183
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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2783 M367T4130 367.200012207031 367.200012207031 367.200012207031 4130.00265569564 4130.00265569564 4130.00265569564 1 0 1 [2M-H+Cl]2- 350.227 23 1.40358858095099 0.931325725534609 0.452589867382761
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2784 M367T3843 367.200012207031 367.200012207031 367.200012207031 3843.40060985387 3843.40060985387 3843.40060985387 1 0 1 [M-H]- 368.206 [2M-3H]3- 552.308 21 1.17272715963489 0.5415633386241 0.653588583337118
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2785 M367T3332 367.300018310547 367.300018310547 367.300018310547 3332.27914258093 3332.27914258093 3332.27914258093 1 0 1 1081 1.35475102326422 0.263232911323295 0.817232164992227
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2786 M367T3833 367.300018310547 367.300018310547 367.300018310547 3832.63372811098 3832.63372811098 3832.63372811098 1 1 0 75 2.20907513138294 -0.498613631931599 0.685342476056511
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2787 M367T4169 367.300018310547 367.300018310547 367.300018310547 4168.75137888537 4168.75137888537 4168.75137888537 1 0 1 236 17.476214736194 2.21020986363569 0.269590937431475
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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2788 M367T3776 367.300018310547 367.300018310547 367.300018310547 3776.10517790588 3776.10517790588 3776.10517790588 1 1 0 254 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2789 M367T3397 367.300018310547 367.300018310547 367.300018310547 3397.12897169193 3397.12897169193 3397.12897169193 1 0 1 481 1.78010092356353 0.382073909381092 0.747664035476685
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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2790 M367T4051 367.300018310547 367.300018310547 367.300018310547 4050.89620299928 4050.89620299928 4050.89620299928 1 0 1 3424 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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2791 M367T3718 367.300018310547 367.300018310547 367.300018310547 3718.49152830969 3718.49152830969 3718.49152830969 1 0 1 3444 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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2792 M368T2606 367.800018310547 367.800018310547 367.800018310547 2606.27628676082 2606.27628676082 2606.27628676082 1 1 0 4011 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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2793 M368T2845 367.899993896484 367.899993896484 367.899993896484 2844.89379581084 2844.89379581084 2844.89379581084 1 1 0 5526 1.7331459267246 -0.36639920295012 0.756717294208017
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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2794 M368T2542 368 368 368 2541.966668269 2541.966668269 2541.966668269 1 0 1 5546 2.5355022426407 9.86961826833116 0.0130610212994986
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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2795 M368T4256 368.100006103516 368.100006103516 368.100006103516 4256.34315089905 4256.34315089905 4256.34315089905 1 0 1 339 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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2796 M368T3405 368.100006103516 368.100006103516 368.100006103516 3404.84104307489 3404.84104307489 3404.84104307489 1 0 1 1321 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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2797 M368T4388 368.100006103516 368.100006103516 368.100006103516 4387.79915089905 4387.79915089905 4387.79915089905 1 0 1 314 Inf 1.83993482464832 0.316933001273199
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2798 M368T3819 368.100006103516 368.100006103516 368.100006103516 3818.51340129171 3818.51340129171 3818.51340129171 1 1 0 2388 Inf -2.99705705983039 0.20502028364091
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2799 M368T3867 368.100006103516 368.100006103516 368.100006103516 3867.0510184785 3867.0510184785 3867.0510184785 1 0 1 1379 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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2800 M368T3525 368.200012207031 368.200012207031 368.200012207031 3524.8179519315 3522.87194622765 3526.76395763535 2 1 1 [48][M+1]- 1 1.20506536469344 1.15558370496125 0.401544034637418
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2801 M368T4132 368.200012207031 368.200012207031 368.200012207031 4131.57917077552 4131.57917077552 4131.57917077552 1 1 0 23 1.07842735024135 0.571676628635319 0.630029577989483
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2802 M368T2719 368.200012207031 368.200012207031 368.200012207031 2719.29194342361 2719.29194342361 2719.29194342361 1 1 0 2481 Inf -1.41988700243985 0.390625823414645
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2803 M368T4092 368.300018310547 368.300018310547 368.300018310547 4092.39294372743 4092.39294372743 4092.39294372743 1 1 0 4963 1.14994380949288 -0.306208189474193 0.789372792773818
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2804 M368T3626 368.300018310547 368.300018310547 368.300018310547 3625.889727528 3625.889727528 3625.889727528 1 1 0 1611 5.12690618808056 -0.790062207876129 0.566618316736223
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2805 M368T4435 368.5 368.5 368.5 4434.74815089905 4434.74815089905 4434.74815089905 1 0 1 313 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2806 M369T4461 369 369 369 4460.57322276304 4460.57322276304 4460.57322276304 1 1 0 6242 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2807 M369T4302 369 369 369 4302.19440158956 4302.19440158956 4302.19440158956 1 1 0 6191 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2808 M369T3513 369.100006103516 369.100006103516 369.100006103516 3512.51798087768 3512.51798087768 3512.51798087768 1 1 0 4512 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2809 M369T4264 369.100006103516 369.100006103516 369.100006103516 4264.16815089905 4264.16815089905 4264.16815089905 1 0 1 230 Inf 1 0.5
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lecorguille
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2810 M369T2636 369.100006103516 369.100006103516 369.100006103516 2636.44564924738 2636.44564924738 2636.44564924738 1 1 0 2646 3.10712117834551 -0.958728682669818 0.46707808648502
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2811 M369T3030 369.100006103516 369.100006103516 369.100006103516 3030.39827680018 3030.39827680018 3030.39827680018 1 0 1 2118 1.16211538946268 0.142753898885169 0.902944641418998
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2812 M369T4287 369.100006103516 369.100006103516 369.100006103516 4286.86322276304 4286.86322276304 4286.86322276304 1 1 0 6094 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2813 M369T2592 369.200012207031 369.200012207031 369.200012207031 2592.19128676082 2592.19128676082 2592.19128676082 2 1 0 2889 1.01208100097081 0.2093643609629 0.85925619621623
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2814 M369T3766 369.200012207031 369.200012207031 369.200012207031 3766.01705575168 3765.89841847115 3766.13569303222 2 1 1 13 1.42588726353188 0.369972047768252 0.754243651302163
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2815 M369T4217 369.200012207031 369.200012207031 369.200012207031 4216.60195708002 4210.82391431008 4222.37999984997 2 1 1 [49][M]- 164 1.37023491473624 1.28888397346753 0.385374009801137
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2816 M369T2556 369.200012207031 369.200012207031 369.200012207031 2556.051668269 2556.051668269 2556.051668269 1 0 1 3074 1.03893066140815 0.419501518324471 0.719951279252653
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2817 M369T2625 369.200012207031 369.200012207031 369.200012207031 2625.00692983762 2625.00692983762 2625.00692983762 1 0 1 2616 1.07489653398532 1.92305031951017 0.25102558363065
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2818 M369T2570 369.200012207031 369.200012207031 369.200012207031 2570.28228676082 2570.28228676082 2570.28228676082 1 1 0 5295 1.03959764707739 -0.376241481505477 0.751274866273108
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2819 M369T4393 369.200012207031 369.200012207031 369.200012207031 4393.39074443202 4393.39074443202 4393.39074443202 1 0 1 269 4.36776859504126 3.02214810492456 0.136657278706659
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2820 M369T2688 369.300018310547 369.300018310547 369.300018310547 2687.58718990559 2687.58718990559 2687.58718990559 1 0 1 6 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2821 M369T3472 369.300018310547 369.300018310547 369.300018310547 3471.50706421322 3471.50706421322 3471.50706421322 1 1 0 1792 5.58620873364777 -0.808141215635283 0.560608010906367
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2822 M369T4220 369.300018310547 369.300018310547 369.300018310547 4220.29556187735 4220.29556187735 4220.29556187735 1 0 1 5321 13.1001265321252 1.35902203484055 0.399711683309056
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2823 M369T4129 369.399993896484 369.399993896484 369.399993896484 4128.76175394237 4128.76175394237 4128.76175394237 1 0 1 1487 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2824 M369T4482 369.399993896484 369.399993896484 369.399993896484 4481.69615089905 4481.69615089905 4481.69615089905 1 0 1 308 6.93055555555597 2.16449066915229 0.227095375143776
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2825 M369T4331 369.399993896484 369.399993896484 369.399993896484 4331.46115089905 4331.46115089905 4331.46115089905 1 0 1 272 8.14457831325278 1.19084468417255 0.43636943387513
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2826 M369T4429 369.399993896484 369.399993896484 369.399993896484 4429.27422276304 4429.27422276304 4429.27422276304 1 1 0 6186 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2827 M369T4190 369.399993896484 369.399993896484 369.399993896484 4190.4073075892 4190.4073075892 4190.4073075892 1 0 1 6078 5.9845802172004 0.821514068628534 0.556225191081356
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2828 M370T4020 370 370 370 4020.22069432323 4020.22069432323 4020.22069432323 1 1 0 5574 Inf -1 0.5
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lecorguille
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2829 M370T2686 370.100006103516 370.100006103516 370.100006103516 2685.99992572252 2685.99992572252 2685.99992572252 1 0 1 [M+Cl]- 335.127 6 1.01937305025158 0.0256068947223422 0.982868088777218
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2830 M370T3735 370.100006103516 370.100006103516 370.100006103516 3735.48344916275 3735.48344916275 3735.48344916275 1 1 0 84 9.41464042295755 -1.29736060580673 0.410509565120364
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2831 M370T2564 370.100006103516 370.100006103516 370.100006103516 2563.876668269 2563.876668269 2563.876668269 1 0 1 3059 2.99884999640625 -2.01399336654832 0.187043713700388
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2832 M370T2590 370.100006103516 370.100006103516 370.100006103516 2590.480668269 2590.480668269 2590.480668269 1 0 1 2890 2.34626213257796 -1.21565522704799 0.387437288726469
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2833 M370T3076 370.200012207031 370.200012207031 370.200012207031 3075.97977208061 3075.97977208061 3075.97977208061 1 0 1 48 1.80348908900807 1.52889178465588 0.368747574763742
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2834 M370T3915 370.200012207031 370.200012207031 370.200012207031 3915.31482802284 3915.31482802284 3915.31482802284 1 1 0 5151 3.50132131815248 -1.35891597690329 0.372097866544105
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2835 M370T4220 370.200012207031 370.200012207031 370.200012207031 4220.29556187735 4220.29556187735 4220.29556187735 1 0 1 [49][M+1]- 164 3.43007592361135 8.83553941602477 0.0716768952817981
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2836 M370T4463 370.200012207031 370.200012207031 370.200012207031 4462.91715089905 4462.91715089905 4462.91715089905 1 0 1 228 2.23923444976064 0.505318961272712 0.682031755069049
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2837 M370T4221 370.300018310547 370.300018310547 370.300018310547 4221.10864116969 4221.10864116969 4221.10864116969 1 1 0 246 9.20533656294172 -1.9910849535941 0.27418594307271
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2838 M370T3514 370.300018310547 370.300018310547 370.300018310547 3514.09305914328 3514.09305914328 3514.09305914328 1 1 0 396 2.981473373039 -0.630097887326256 0.625798560623703
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2839 M370T3397 370.300018310547 370.300018310547 370.300018310547 3397.48157498888 3397.48157498888 3397.48157498888 1 1 0 482 1.48572969954713 5.03035131162755 0.0794863777793191
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2840 M370T4365 370.300018310547 370.300018310547 370.300018310547 4365.22174443202 4365.22174443202 4365.22174443202 1 0 1 328 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2841 M370T4255 370.399993896484 370.399993896484 370.399993896484 4254.77815089905 4254.77815089905 4254.77815089905 1 0 1 262 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2842 M370T4183 370.5 370.5 370.5 4182.67582713382 4182.67582713382 4182.67582713382 1 0 1 248 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2843 M371T4194 370.800018310547 370.800018310547 370.800018310547 4194.40921882124 4194.40921882124 4194.40921882124 1 1 0 6162 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2844 M371T4143 370.899993896484 370.899993896484 370.899993896484 4142.54464326502 4142.54464326502 4142.54464326502 1 1 0 4220 2.97402472864081 -0.871927813216734 0.503010461943732
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2845 M371T3133 371 371 371 3132.9972364283 3132.9972364283 3132.9972364283 1 0 1 4995 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2846 M371T3817 371 371 371 3816.57302395962 3816.57302395962 3816.57302395962 1 0 1 2389 1.02980217284555 0.0207616759643094 0.985322298804169
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2847 M371T3167 371 371 371 3167.48065831574 3167.48065831574 3167.48065831574 1 0 1 773 2.28457402222207 0.700584668252732 0.566216308630406
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2848 M371T3926 371 371 371 3925.84217251709 3925.84217251709 3925.84217251709 1 0 1 2964 Inf 2.97115986748619 0.206684803290653
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2849 M371T3208 371 371 371 3208.0722327539 3208.0722327539 3208.0722327539 1 0 1 4319 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2850 M371T3640 371.200012207031 371.200012207031 371.200012207031 3639.58275095041 3638.09766475263 3640.4266878131 4 2 2 59 1.03062113102994 -0.07035787109084 0.95044215736416
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2851 M371T4389 371.200012207031 371.200012207031 371.200012207031 4389.36415089905 4389.36415089905 4389.36415089905 1 0 1 331 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2852 M371T4218 371.300018310547 371.300018310547 371.300018310547 4217.96617539246 4217.96617539246 4217.96617539246 1 1 0 5327 5.27878925930494 -1.75692705753394 0.272641256513879
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2853 M372T2689 371.800018310547 371.800018310547 371.800018310547 2688.93898862864 2688.93898862864 2688.93898862864 1 0 1 651 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2854 M372T2673 371.899993896484 371.899993896484 371.899993896484 2673.25551348623 2673.25551348623 2673.25551348623 1 1 0 4044 13.168659192004 -0.921409262327274 0.524613362681706
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2855 M372T4177 371.899993896484 371.899993896484 371.899993896484 4177.13473042771 4177.13473042771 4177.13473042771 1 1 0 4370 4.02656929621809 -0.742948977528526 0.588632058025064
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2856 M372T3168 372 372 372 3167.72365472768 3167.72365472768 3167.72365472768 1 1 0 8 2.13754290934056 -0.528225427083771 0.688550980677697
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2857 M372T3802 372 372 372 3802.32909026307 3802.32909026307 3802.32909026307 1 0 1 2834 3.32849122391823 0.66997985202885 0.609846886641931
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2858 M372T3867 372 372 372 3867.25281011878 3867.25281011878 3867.25281011878 1 1 0 1380 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2859 M372T4122 372 372 372 4122.45552011977 4122.45552011977 4122.45552011977 1 0 1 1723 1.2397532676504 0.369391566908342 0.747997994409835
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2860 M372T3737 372.100006103516 372.100006103516 372.100006103516 3737.40215453346 3737.40215453346 3737.40215453346 1 0 1 155 1.1257004104696 0.116953187104382 0.917892009342252
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2861 M372T3430 372.100006103516 372.100006103516 372.100006103516 3429.66746677901 3429.66746677901 3429.66746677901 1 0 1 5265 14.0183287479895 1.13564333250291 0.457399626199873
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2862 M372T3328 372.200012207031 372.200012207031 372.200012207031 3327.72543495697 3327.72543495697 3327.72543495697 2 0 1 [50][M]- 1104 54.3975066741429 0.997560018205086 0.50077750709048
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2863 M372T3384 372.200012207031 372.200012207031 372.200012207031 3384.33240585215 3382.01892208389 3386.6458896204 2 1 0 [51][M]- 25 2.77850467918275 -0.620182404514426 0.629327643332021
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2864 M372T3597 372.200012207031 372.200012207031 372.200012207031 3597.25775853295 3593.21101663136 3601.30450043454 2 1 1 1441 1.32500923694943 -0.211121444794001 0.854353777149199
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2865 M372T3348 372.200012207031 372.200012207031 372.200012207031 3347.8458781399 3347.8458781399 3347.8458781399 1 0 1 695 2.95736009576975 0.639406989091255 0.622098505110364
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lecorguille
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2866 M372T2580 372.200012207031 372.200012207031 372.200012207031 2579.525668269 2579.525668269 2579.525668269 1 0 1 4070 13.7912195121951 1.96414591319026 0.29080626729053
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2867 M372T4190 372.200012207031 372.200012207031 372.200012207031 4190.30045315667 4190.30045315667 4190.30045315667 1 0 1 6079 Inf 1 0.5
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lecorguille
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2868 M372T3569 372.200012207031 372.200012207031 372.200012207031 3569.49851572137 3569.49851572137 3569.49851572137 1 1 0 27 4.37779716399689 -0.793588902672042 0.564518963678836
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2869 M372T3697 372.300018310547 372.300018310547 372.300018310547 3696.96574178763 3696.96574178763 3696.96574178763 1 1 0 5483 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2870 M372T4221 372.300018310547 372.300018310547 372.300018310547 4221.33434899811 4221.33434899811 4221.33434899811 1 0 1 5985 Inf 1.93667171019412 0.303439538083692
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2871 M372T4171 372.300018310547 372.300018310547 372.300018310547 4171.35699561709 4171.35699561709 4171.35699561709 1 0 1 4389 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2872 M372T3207 372.300018310547 372.300018310547 372.300018310547 3206.50913659474 3206.50913659474 3206.50913659474 1 0 1 4291 1.26832394165867 0.166131460283554 0.884060738544179
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2873 M373T3756 373 373 373 3756.37753503264 3756.37753503264 3756.37753503264 1 0 1 982 1.15514095515595 0.101541463021956 0.928551560298949
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2874 M373T3138 373 373 373 3137.72690179769 3137.72690179769 3137.72690179769 1 0 1 3118 1.63712137415237 -0.565068112643871 0.644641185741897
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2875 M373T3325 373.200012207031 373.200012207031 373.200012207031 3324.63629404843 3324.63629404843 3324.63629404843 1 0 1 [50][M+1]- 1105 39.0099800125924 0.997379410848914 0.500824343070209
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2876 M373T4137 373.200012207031 373.200012207031 373.200012207031 4136.64576660025 4136.64576660025 4136.64576660025 1 0 1 3973 10.1131797143273 0.896745861401977 0.532299235943951
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2877 M373T3380 373.200012207031 373.200012207031 373.200012207031 3380.47786867874 3380.47786867874 3380.47786867874 1 1 0 [51][M+1]- 25 2.13875859721429 -0.498450448436987 0.684845925096893
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2878 M373T4165 373.200012207031 373.200012207031 373.200012207031 4165.04329049758 4165.04329049758 4165.04329049758 1 0 1 6157 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2879 M373T4016 373.200012207031 373.200012207031 373.200012207031 4016.3492449455 4016.3492449455 4016.3492449455 1 1 0 [M-H+NaCOOH]- 306.227 242 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2880 M373T2996 373.200012207031 373.200012207031 373.200012207031 2995.83048403819 2995.83048403819 2995.83048403819 1 1 0 1837 3.71472678700989 -0.705678816059344 0.596301685554682
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2881 M373T3472 373.300018310547 373.300018310547 373.300018310547 3471.51183376243 3471.51183376243 3471.51183376243 1 0 1 1793 Inf 2.25325581732938 0.265908398575049
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2882 M374T4119 373.800018310547 373.800018310547 373.800018310547 4119.30268860621 4119.30268860621 4119.30268860621 1 0 1 4542 Inf 1.14222710754829 0.457795370302359
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2883 M374T4065 373.899993896484 373.899993896484 373.899993896484 4064.86823339269 4064.86823339269 4064.86823339269 1 0 1 3882 1.04710805953259 0.0408591121171982 0.972432221471117
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2884 M374T4133 373.899993896484 373.899993896484 373.899993896484 4133.10622634158 4133.10622634158 4133.10622634158 1 0 1 1488 8.20696855097608 1.11128716670403 0.459696539169433
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2885 M374T3875 373.899993896484 373.899993896484 373.899993896484 3874.75776665632 3874.75776665632 3874.75776665632 1 1 0 2743 Inf -2.66737449443968 0.228344959825559
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2886 M374T2861 374 374 374 2861.1437462728 2861.1437462728 2861.1437462728 1 0 1 3645 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2887 M374T2928 374 374 374 2927.67227045736 2927.67227045736 2927.67227045736 1 1 0 2869 1.98098132118172 -0.442067980828374 0.714460929906554
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2888 M374T3948 374.200012207031 374.200012207031 374.200012207031 3948.05729081349 3948.05729081349 3948.05729081349 1 1 0 91 3.97371891820355 -0.725719597095181 0.588975318836928
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2889 M374T3376 374.200012207031 374.200012207031 374.200012207031 3375.85762156343 3375.85762156343 3375.85762156343 1 1 0 [51][M+2]- 25 2.03048272008048 -0.585165914218796 0.642784311969371
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2890 M374T3313 374.300018310547 374.300018310547 374.300018310547 3313.42537332671 3313.42537332671 3313.42537332671 1 1 0 4 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2891 M374T4050 374.300018310547 374.300018310547 374.300018310547 4049.61097536975 4049.61097536975 4049.61097536975 1 1 0 3404 21.9107920878001 -0.953367986424906 0.514666789712839
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2892 M374T3060 374.300018310547 374.300018310547 374.300018310547 3059.67590615795 3059.67590615795 3059.67590615795 1 1 0 5909 13.0623650112367 -1.19986672199778 0.439318699832603
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2893 M374T3683 374.300018310547 374.300018310547 374.300018310547 3682.99561425987 3682.99561425987 3682.99561425987 1 0 1 5 3.33858020336569 6.1742533025137 0.0256831383655169
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2894 M374T3456 374.300018310547 374.300018310547 374.300018310547 3455.56264424004 3455.56264424004 3455.56264424004 1 1 0 1272 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2895 M374T2747 374.300018310547 374.300018310547 374.300018310547 2746.52752074663 2746.52752074663 2746.52752074663 1 0 1 4351 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2896 M374T3884 374.399993896484 374.399993896484 374.399993896484 3884.15468055726 3884.15468055726 3884.15468055726 1 1 0 2236 7.83626823506391 -0.865370516310284 0.54215749161882
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2897 M375T3301 374.899993896484 374.899993896484 374.899993896484 3300.78341396747 3300.78341396747 3300.78341396747 1 1 0 5385 6.62464945536878 -0.839537506983506 0.550392678041598
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2898 M375T3237 374.899993896484 374.899993896484 374.899993896484 3236.82694726379 3236.82694726379 3236.82694726379 1 0 1 2714 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2899 M375T2848 374.899993896484 374.899993896484 374.899993896484 2848.30914179234 2848.30914179234 2848.30914179234 1 0 1 5631 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2900 M375T4119 374.899993896484 374.899993896484 374.899993896484 4118.91791660954 4118.91791660954 4118.91791660954 1 1 0 4557 4.23867350222788 -0.743661421964212 0.582572001415791
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2901 M375T3839 374.899993896484 374.899993896484 374.899993896484 3838.67095770774 3838.67095770774 3838.67095770774 1 0 1 3163 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2902 M375T3181 374.899993896484 374.899993896484 374.899993896484 3181.37964662454 3181.37964662454 3181.37964662454 1 0 1 2191 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2903 M375T3533 375 375 375 3532.99268892389 3532.99268892389 3532.99268892389 1 1 0 1930 1.56822571853041 -0.65250780506073 0.594877212305638
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2904 M375T3560 375 375 375 3559.95397882657 3559.95397882657 3559.95397882657 1 1 0 1631 1.95984086084301 -0.723449763951413 0.545783428702411
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2905 M375T2956 375.100006103516 375.100006103516 375.100006103516 2956.1132744208 2956.1132744208 2956.1132744208 1 0 1 3185 1.05110099672032 0.107378578470678 0.924874238627161
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2906 M375T4139 375.100006103516 375.100006103516 375.100006103516 4139.39602511555 4139.39602511555 4139.39602511555 1 1 0 4221 1.92811529282121 -0.427307047599145 0.722412901523409
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2907 M375T2740 375.200012207031 375.200012207031 375.200012207031 2739.56197376761 2739.56197376761 2739.56197376761 1 1 0 4430 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2908 M375T2994 375.200012207031 375.200012207031 375.200012207031 2994.06985896253 2994.06985896253 2994.06985896253 1 0 1 32 34.1394319002645 1.02513867677775 0.492073808046058
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2909 M375T3683 375.200012207031 375.200012207031 375.200012207031 3682.87772773054 3682.87772773054 3682.87772773054 1 1 0 [M-H+CF3COOH]- 242.225 5 2.35981085716898 -0.753708165322653 0.587455299631694
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2910 M375T2761 375.300018310547 375.300018310547 375.300018310547 2760.79711477182 2760.79711477182 2760.79711477182 1 0 1 176 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2911 M375T3584 375.300018310547 375.300018310547 375.300018310547 3583.94704830033 3583.94704830033 3583.94704830033 1 0 1 1699 12.8086422075642 0.9191307870732 0.525322253898469
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2912 M375T4099 375.300018310547 375.300018310547 375.300018310547 4098.81380473002 4098.81380473002 4098.81380473002 1 0 1 5098 2.40198831079453 0.538845873853694 0.66592898394394
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2913 M375T3789 375.300018310547 375.300018310547 375.300018310547 3789.28492301941 3789.28492301941 3789.28492301941 1 0 1 4454 4.1313537516978 0.736675259349896 0.585048510640445
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2914 M375T3388 375.399993896484 375.399993896484 375.399993896484 3387.92802216455 3387.92802216455 3387.92802216455 1 1 0 483 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2915 M375T3804 375.399993896484 375.399993896484 375.399993896484 3804.37595168667 3804.37595168667 3804.37595168667 1 1 0 2835 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2916 M375T3954 375.399993896484 375.399993896484 375.399993896484 3954.06314819796 3954.06314819796 3954.06314819796 1 0 1 5456 8.47347108356674 1.35994861569286 0.392873729920162
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2917 M376T2872 375.800018310547 375.800018310547 375.800018310547 2872.09955249099 2872.09955249099 2872.09955249099 1 1 0 133 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2918 M376T4012 375.800018310547 375.800018310547 375.800018310547 4011.58991179848 4011.58991179848 4011.58991179848 1 1 0 5216 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2919 M376T3341 375.899993896484 375.899993896484 375.899993896484 3341.47361287755 3341.47361287755 3341.47361287755 1 1 0 5510 1.23356281840111 -0.157065187277901 0.889733319152268
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2920 M376T3329 375.899993896484 375.899993896484 375.899993896484 3329.10122884929 3329.10122884929 3329.10122884929 1 0 1 15 Inf 1.53302706452778 0.367961990439493
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2921 M376T3175 375.899993896484 375.899993896484 375.899993896484 3175.0253700214 3175.0253700214 3175.0253700214 1 0 1 758 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2922 M376T3989 375.899993896484 375.899993896484 375.899993896484 3989.36430026676 3989.36430026676 3989.36430026676 1 1 0 4472 Inf -2.16630755765838 0.275319492321539
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2923 M376T3382 375.899993896484 375.899993896484 375.899993896484 3381.76815667381 3381.76815667381 3381.76815667381 1 1 0 1561 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2924 M376T3762 375.899993896484 375.899993896484 375.899993896484 3762.00170739274 3762.00170739274 3762.00170739274 1 1 0 983 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2925 M376T3637 376 376 376 3637.31424070884 3637.31424070884 3637.31424070884 1 1 0 2853 1.12534997420192 0.0832635195059513 0.941318219642806
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2926 M376T3445 376.100006103516 376.100006103516 376.100006103516 3444.9796756261 3444.9796756261 3444.9796756261 1 1 0 [M-H+CF3COOH]- 243.125 62 2.2677073241892 -0.858651643302606 0.545791558579554
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2927 M376T2543 376.100006103516 376.100006103516 376.100006103516 2543.38497459635 2543.38497459635 2543.38497459635 1 1 0 153 2.68311775268112 -0.819344721694467 0.557641356494187
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2928 M376T3713 376.200012207031 376.200012207031 376.200012207031 3713.20986977217 3705.93273745051 3719.10248465668 4 2 2 17 1.16440189154334 0.237015148014511 0.845674358727413
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2929 M376T3455 376.200012207031 376.200012207031 376.200012207031 3454.96854913817 3452.3743092934 3457.56278898294 2 2 0 [M-H]- 377.212 19 12.1724847875947 -5.47807406012048 0.100072163281518
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2930 M376T3096 376.200012207031 376.200012207031 376.200012207031 3095.8462508652 3095.8462508652 3095.8462508652 1 0 1 5378 2.8343464029562 1.44872679711343 0.291517643472754
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2931 M376T2692 376.300018310547 376.300018310547 376.300018310547 2692.20544578263 2692.20544578263 2692.20544578263 1 0 1 5872 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
2932 M376T3921 376.300018310547 376.300018310547 376.300018310547 3920.66548931598 3920.66548931598 3920.66548931598 1 0 1 2993 4.54507947086963 1.03330668151962 0.488334893305068
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
2933 M376T3105 376.300018310547 376.300018310547 376.300018310547 3105.32542099572 3105.32542099572 3105.32542099572 1 1 0 3136 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
2934 M376T3692 376.300018310547 376.300018310547 376.300018310547 3691.86366065346 3691.86366065346 3691.86366065346 1 0 1 595 6.43925528258123 0.834697182698887 0.551951273530282
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
2935 M376T3403 376.300018310547 376.300018310547 376.300018310547 3403.29749142804 3403.29749142804 3403.29749142804 1 0 1 1322 2.77075361220372 1.35879584159823 0.310714007952437
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2936 M376T3904 376.399993896484 376.399993896484 376.399993896484 3904.42566271432 3904.42566271432 3904.42566271432 1 1 0 4788 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
2937 M376T3376 376.399993896484 376.399993896484 376.399993896484 3375.85762156343 3375.85762156343 3375.85762156343 1 1 0 25 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2938 M376T3175 376.399993896484 376.399993896484 376.399993896484 3175.0253700214 3175.0253700214 3175.0253700214 1 0 1 759 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2939 M377T3376 376.899993896484 376.899993896484 376.899993896484 3375.61073626906 3375.61073626906 3375.61073626906 1 1 0 1562 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
2940 M377T3189 376.899993896484 376.899993896484 376.899993896484 3189.31992600977 3189.31992600977 3189.31992600977 1 0 1 2192 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2941 M377T3334 376.899993896484 376.899993896484 376.899993896484 3333.91486419605 3333.91486419605 3333.91486419605 1 0 1 1106 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2942 M377T4119 377 377 377 4119.22316030312 4119.14363200002 4119.30268860621 2 0 2 4558 21.9934931224758 20.8384464963795 0.0280482713890629
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lecorguille
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2943 M377T3917 377 377 377 3916.86998621818 3916.86998621818 3916.86998621818 1 1 0 5139 4.10411604737845 -1.62205244748259 0.270721857153404
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2944 M377T3070 377 377 377 3069.85631402629 3069.85631402629 3069.85631402629 1 1 0 48 1.29155415961199 -0.835492797499642 0.53348887078586
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2945 M377T4087 377 377 377 4086.58270444214 4086.58270444214 4086.58270444214 1 0 1 4977 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2946 M377T3597 377 377 377 3596.54262729206 3596.54262729206 3596.54262729206 1 1 0 1451 Inf -1.57395029428346 0.360328826673432
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
2947 M377T4080 377.100006103516 377.100006103516 377.100006103516 4080.38086998618 4080.38086998618 4080.38086998618 1 0 1 5735 1.29566299160024 -0.180647300354993 0.874231116548002
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
2948 M377T3077 377.100006103516 377.100006103516 377.100006103516 3077.06004455804 3077.06004455804 3077.06004455804 1 0 1 5536 1.05115934621306 -0.122306026613011 0.919515768446243
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
2949 M377T3709 377.300018310547 377.300018310547 377.300018310547 3709.06819106466 3709.06819106466 3709.06819106466 1 0 1 1178 2.11606266287403 -1.02558735299802 0.453486956753046
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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2950 M377T2884 377.300018310547 377.300018310547 377.300018310547 2883.74499442463 2883.74499442463 2883.74499442463 1 0 1 5498 2.64209218728328 0.581270619270214 0.646614751564269
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
2951 M377T3840 377.300018310547 377.300018310547 377.300018310547 3840.48293939734 3840.48293939734 3840.48293939734 1 1 0 3164 1.39607556317785 2.45452852364519 0.245167965959586
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2952 M377T3373 377.300018310547 377.300018310547 377.300018310547 3372.50532490707 3372.50532490707 3372.50532490707 1 0 1 1563 1.77604801562906 0.380747650037512 0.748424117989098
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2953 M377T4135 377.300018310547 377.300018310547 377.300018310547 4135.06884588458 4135.06884588458 4135.06884588458 1 0 1 3974 Inf 2.39071727897 0.252208918583428
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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2954 M377T2584 377.300018310547 377.300018310547 377.300018310547 2584.07397459635 2584.07397459635 2584.07397459635 1 1 0 5741 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
2955 M377T2736 377.399993896484 377.399993896484 377.399993896484 2735.86690351336 2735.86690351336 2735.86690351336 1 0 1 2482 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2956 M377T3339 377.399993896484 377.399993896484 377.399993896484 3338.60479100277 3338.60479100277 3338.60479100277 1 1 0 1107 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2957 M378T4009 377.5 377.5 377.5 4008.97224519849 4008.97224519849 4008.97224519849 1 0 1 5217 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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2958 M378T4070 377.5 377.5 377.5 4070.44866369949 4070.44866369949 4070.44866369949 1 0 1 3883 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2959 M378T3345 377.899993896484 377.899993896484 377.899993896484 3344.8775026371 3344.8775026371 3344.8775026371 1 1 0 802 2.05450112645982 -0.4614995121065 0.704213222843826
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2960 M378T3210 377.899993896484 377.899993896484 377.899993896484 3210.15264108013 3210.15264108013 3210.15264108013 1 1 0 4320 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2961 M378T4065 378 378 378 4064.86823339269 4064.86823339269 4064.86823339269 1 0 1 3884 5.37462868560979 0.800207647239048 0.563232844004103
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2962 M378T3500 378 378 378 3499.90373818767 3499.90373818767 3499.90373818767 1 1 0 3363 4.63676126255278 -1.99604385350219 0.29515813953557
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
2963 M378T3450 378 378 378 3449.72197612356 3449.72197612356 3449.72197612356 1 1 0 74 3.99364751896529 -0.727152997925852 0.588458485739589
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2964 M378T3560 378 378 378 3559.69312983924 3559.69312983924 3559.69312983924 1 1 0 1665 1.02700947937922 0.0270091479144393 0.982809458595683
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
2965 M378T3763 378 378 378 3762.94929187377 3762.94929187377 3762.94929187377 1 1 0 936 3.24729766877681 -0.954977956045907 0.514600722495884
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2966 M378T2918 378 378 378 2918.39175940831 2918.39175940831 2918.39175940831 1 1 0 56 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2967 M378T2644 378.100006103516 378.100006103516 378.100006103516 2643.99065623712 2643.99065623712 2643.99065623712 1 1 0 5652 4.43381005680709 -1.4724585402017 0.323010016099244
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2968 M378T3172 378.300018310547 378.300018310547 378.300018310547 3172.16099774074 3172.16099774074 3172.16099774074 1 0 1 742 Inf 1.26983149637482 0.424673848910195
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2969 M378T2659 378.300018310547 378.300018310547 378.300018310547 2658.87589905919 2658.87589905919 2658.87589905919 1 1 0 4045 9.0663903710209 -0.884339551343829 0.536182818853804
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
2970 M378T3891 378.399993896484 378.399993896484 378.399993896484 3891.34438369106 3891.34438369106 3891.34438369106 1 0 1 4900 5.44313131834362 0.802845743146855 0.562357892395768
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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2971 M378T3356 378.399993896484 378.399993896484 378.399993896484 3355.56487489459 3355.56487489459 3355.56487489459 1 0 1 729 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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2972 M378T3382 378.399993896484 378.399993896484 378.399993896484 3381.73449888661 3381.73449888661 3381.73449888661 1 0 1 1564 7.10435626306663 0.850853648167822 0.546769064803007
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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2973 M379T4037 378.600006103516 378.600006103516 378.600006103516 4037.48559301773 4037.48559301773 4037.48559301773 1 1 0 3766 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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2974 M379T4094 378.600006103516 378.600006103516 378.600006103516 4094.33528157085 4094.33528157085 4094.33528157085 1 0 1 5099 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2975 M379T4103 378.899993896484 378.899993896484 378.899993896484 4103.36860044401 4103.36860044401 4103.36860044401 1 1 0 6175 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2976 M379T2632 378.899993896484 378.899993896484 378.899993896484 2632.16386004811 2632.16386004811 2632.16386004811 1 0 1 2619 5.35110010057047 0.799285512526556 0.563539191151777
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2977 M379T2918 379 379 379 2917.53423460288 2917.53423460288 2917.53423460288 1 0 1 2759 1.92264624594028 0.42574042025964 0.723265296705072
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2978 M379T3360 379 379 379 3360.1798016686 3360.1798016686 3360.1798016686 1 1 0 7 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2979 M379T3010 379 379 379 3010.26895926564 3010.26895926564 3010.26895926564 1 0 1 2076 5.98322191076184 2.44809188228465 0.166690811859797
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2980 M379T3326 379.100006103516 379.100006103516 379.100006103516 3325.84639959218 3324.63629404843 3326.04085582617 4 2 2 [M-H]- 380.112 15 1.5703168782444 -0.938536707215349 0.459015173089376
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2981 M379T3505 379.100006103516 379.100006103516 379.100006103516 3505.18197644127 3505.18197644127 3505.18197644127 1 0 1 [M-H+NaCOOH]- 312.127 76 3.8938137468029 2.5143606446117 0.159924187165396
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2982 M379T4127 379.100006103516 379.100006103516 379.100006103516 4126.87847123092 4126.87847123092 4126.87847123092 1 1 0 1489 1.82331397668335 -0.574068989191547 0.631135848815431
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2983 M379T3191 379.100006103516 379.100006103516 379.100006103516 3190.88909776473 3190.88909776473 3190.88909776473 1 0 1 2215 1.18696441814104 0.188869496614349 0.877483380143064
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2984 M379T3335 379.200012207031 379.200012207031 379.200012207031 3335.46357290839 3335.19806238107 3337.03753699367 3 2 1 [52][M]- 15 1.36165560349589 0.517617259603875 0.660268782380443
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2985 M379T3669 379.200012207031 379.200012207031 379.200012207031 3668.80508470333 3668.80508470333 3668.80508470333 1 0 1 [M-H+CF3COOH]- 246.224 2 2.16353004589344 0.853096560113289 0.549866909630841
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2986 M379T2861 379.200012207031 379.200012207031 379.200012207031 2861.15114527124 2861.15114527124 2861.15114527124 1 1 0 3646 4.93258892079313 -0.781370913400324 0.569545814672443
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2987 M379T3200 379.200012207031 379.200012207031 379.200012207031 3200.25868845643 3200.25868845643 3200.25868845643 1 0 1 1747 2.27578956970206 0.922731702641987 0.500389585284087
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2988 M379T3837 379.300018310547 379.300018310547 379.300018310547 3837.34147794623 3837.34147794623 3837.34147794623 1 1 0 [53][M]- 3157 1.9377806297683 -0.91633083143278 0.516903184582477
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2989 M379T3110 379.300018310547 379.300018310547 379.300018310547 3109.99201166669 3109.99201166669 3109.99201166669 1 0 1 165 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2990 M379T3043 379.300018310547 379.300018310547 379.300018310547 3042.80615767999 3042.80615767999 3042.80615767999 1 0 1 3221 Inf 2.08158287305683 0.285108881397879
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2991 M379T2684 379.399993896484 379.399993896484 379.399993896484 2684.41329800875 2684.41329800875 2684.41329800875 1 0 1 6 Inf 1 0.5
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lecorguille
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2992 M379T3783 379.399993896484 379.399993896484 379.399993896484 3783.04422117973 3783.04422117973 3783.04422117973 1 0 1 3673 Inf 1.3184244855 0.413106980219741
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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2993 M380T3708 380 380 380 3708.1445343506 3708.1445343506 3708.1445343506 1 0 1 1154 1.57061547492038 0.768669628456313 0.574702880121846
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lecorguille
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2994 M380T2886 380 380 380 2885.95789013406 2885.95789013406 2885.95789013406 1 0 1 5659 Inf 1 0.5
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lecorguille
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2995 M380T3919 380 380 380 3919.08843740074 3919.08843740074 3919.08843740074 1 0 1 2994 1.43330422074096 0.315497220035515 0.797115672754328
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lecorguille
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lecorguille
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2997 M380T3423 380 380 380 3423.42619145082 3423.42619145082 3423.42619145082 1 0 1 869 Inf 1 0.5
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lecorguille
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2998 M380T3047 380 380 380 3047.123542227 3047.123542227 3047.123542227 1 1 0 3490 Inf -1 0.5
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lecorguille
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2999 M380T3016 380 380 380 3015.81463817975 3015.81463817975 3015.81463817975 1 1 0 2082 Inf -1 0.5
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lecorguille
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3000 M380T3149 380.100006103516 380.100006103516 380.100006103516 3149.41384586739 3149.24213972326 3149.58555201153 2 1 1 [54][M]- 64 1.40165400716211 -0.375266641930772 0.745560427703416
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lecorguille
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lecorguille
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lecorguille
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3003 M380T3324 380.200012207031 380.200012207031 380.200012207031 3324.27947866842 3319.45772848755 3329.10122884929 2 1 1 [52][M+1]- 15 1.25171776327041 0.339470487405791 0.776263648748491
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lecorguille
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3004 M380T2966 380.200012207031 380.200012207031 380.200012207031 2965.75289998914 2965.75289998914 2965.75289998914 1 1 0 72 6.25319205514469 -0.9631747824094 0.511741307524765
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lecorguille
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3005 M380T3520 380.300018310547 380.300018310547 380.300018310547 3519.777977179 3519.777977179 3519.777977179 1 0 1 352 1.98506976549746 0.443181324412711 0.713866995778919
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lecorguille
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3006 M380T3837 380.300018310547 380.300018310547 380.300018310547 3837.09444263788 3837.09444263788 3837.09444263788 1 0 1 [53][M+1]- 3165 1.01679400189175 -0.0165561593053701 0.989348066968547
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lecorguille
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3007 M380T3874 380.300018310547 380.300018310547 380.300018310547 3874.075633099 3874.075633099 3874.075633099 1 0 1 55 4.59239708310199 0.764337885096047 0.575361359122911
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lecorguille
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3008 M380T4135 380.399993896484 380.399993896484 380.399993896484 4135.06884588458 4135.06884588458 4135.06884588458 1 0 1 3975 5.0364155231822 1.7709223448007 0.263534796824267
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lecorguille
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3009 M381T2683 381 381 381 2683.22747285256 2681.23206234307 2684.06586984756 4 2 2 [M+Cl]- 346.029 [M-H]- 382.006 6 1.08091881298412 -0.16681136140378 0.883754967355947
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lecorguille
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3010 M381T3263 381 381 381 3262.57857847689 3257.51410443234 3267.64305252143 2 0 2 3459 Inf 8.51648351648292 0.0744107566615646
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lecorguille
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3011 M381T3421 381 381 381 3420.60072228854 3420.60072228854 3420.60072228854 1 1 0 870 Inf -1 0.5
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lecorguille
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3012 M381T3432 381 381 381 3432.44528854724 3432.44528854724 3432.44528854724 1 0 1 139 Inf 1 0.5
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lecorguille
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3013 M381T4109 381 381 381 4109.47606512796 4109.47606512796 4109.47606512796 1 1 0 43 4.86901360716742 -0.778372833484624 0.570561758849319
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lecorguille
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3014 M381T3971 381 381 381 3971.12871400763 3971.12871400763 3971.12871400763 1 0 1 2031 Inf 1 0.5
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lecorguille
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3015 M381T3202 381 381 381 3201.82102320952 3201.82102320952 3201.82102320952 1 0 1 1754 Inf 1 0.5
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lecorguille
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3016 M381T3398 381 381 381 3397.64522871033 3397.64522871033 3397.64522871033 1 0 1 501 Inf 1.56674084628131 0.361653035363109
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lecorguille
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3017 M381T2593 381 381 381 2593.46397459635 2593.46397459635 2593.46397459635 1 1 0 61 1.00319613365895 -0.0152521957686511 0.990285528109704
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lecorguille
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3018 M381T3749 381 381 381 3749.49822775919 3749.49822775919 3749.49822775919 1 1 0 1050 Inf -1 0.5
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lecorguille
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3019 M381T3149 381.100006103516 381.100006103516 381.100006103516 3149.41384586739 3149.24213972326 3149.58555201153 2 1 1 [54][M+1]- 64 1.27787246506035 -0.253660712058671 0.826048344530375
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lecorguille
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3020 M381T2632 381.100006103516 381.100006103516 381.100006103516 2632.16386004811 2632.16386004811 2632.16386004811 1 0 1 53 3.18656220477004 1.14936559929549 0.388887189994816
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lecorguille
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3021 M381T3272 381.200012207031 381.200012207031 381.200012207031 3272.25634812786 3272.25634812786 3272.25634812786 1 1 0 5014 3.80447733859027 -0.71293505215075 0.593626997083412
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lecorguille
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3022 M381T3169 381.200012207031 381.200012207031 381.200012207031 3169.20637404524 3169.20637404524 3169.20637404524 1 1 0 774 4.25283827003293 -0.744556750323901 0.582256128295072
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lecorguille
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3023 M381T4108 381.300018310547 381.300018310547 381.300018310547 4108.28946753533 4108.28946753533 4108.28946753533 1 0 1 2303 1.84276362755726 0.40196470294473 0.736398013848431
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lecorguille
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3024 M381T3304 381.300018310547 381.300018310547 381.300018310547 3303.94373016607 3303.94373016607 3303.94373016607 1 1 0 5386 Inf -1 0.5
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lecorguille
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3025 M381T4076 381.300018310547 381.300018310547 381.300018310547 4075.72805891963 4075.72805891963 4075.72805891963 1 0 1 3885 12.1577114106396 0.914658856099615 0.526714025677432
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lecorguille
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3026 M382T2528 381.899993896484 381.899993896484 381.899993896484 2527.73597459635 2527.73597459635 2527.73597459635 1 1 0 5595 6.10393700787407 -0.825170906823879 0.555035228360351
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lecorguille
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3027 M382T2914 381.899993896484 381.899993896484 381.899993896484 2914.42997824767 2914.42997824767 2914.42997824767 1 1 0 56 73.4520784256773 -1.01380310785541 0.495584080673291
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lecorguille
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3028 M382T3517 382 382 382 3516.56170641443 3516.56170641443 3516.56170641443 1 1 0 397 3.09597412646288 -1.04626397044663 0.427896663213531
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lecorguille
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3029 M382T3313 382 382 382 3313.30617288955 3313.30617288955 3313.30617288955 1 0 1 531 5.07533770235492 0.787822235432972 0.567370340961166
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lecorguille
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3030 M382T3628 382 382 382 3628.24021027642 3628.24021027642 3628.24021027642 1 0 1 1612 Inf 1 0.5
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lecorguille
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3031 M382T3169 382 382 382 3168.66779925792 3168.66779925792 3168.66779925792 1 0 1 8 Inf 1 0.5
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lecorguille
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3032 M382T3644 382 382 382 3643.53817866826 3643.53817866826 3643.53817866826 1 1 0 1535 5.60449488173204 -0.80879796107224 0.560391575363006
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lecorguille
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3033 M382T2930 382 382 382 2929.89446868652 2929.89446868652 2929.89446868652 1 1 0 3626 13.4658185795734 -0.923195749950607 0.524057619404111
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lecorguille
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3034 M382T3241 382.100006103516 382.100006103516 382.100006103516 3241.15766361871 3240.75423294586 3241.56109429157 2 1 1 3461 1.67455239609033 -0.859116044138828 0.524943001326791
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lecorguille
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3035 M382T3261 382.100006103516 382.100006103516 382.100006103516 3260.74570744212 3260.74570744212 3260.74570744212 1 1 0 3591 1.4774987120851 -0.710980791206465 0.577120016025236
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lecorguille
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3036 M382T4045 382.100006103516 382.100006103516 382.100006103516 4044.68299305716 4044.68299305716 4044.68299305716 1 0 1 4114 2.02723369040385 1.02492701333071 0.490953505735165
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lecorguille
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3037 M382T2950 382.100006103516 382.100006103516 382.100006103516 2950.139046458 2950.139046458 2950.139046458 1 1 0 70 4.89530584713731 -0.913362294923622 0.52561288083617
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lecorguille
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3038 M382T3786 382.200012207031 382.200012207031 382.200012207031 3786.48422176804 3785.52348094633 3790.12256982157 3 2 1 4446 7.56661211127813 -9.28729448777226 0.0505768795475052
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lecorguille
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3039 M382T2736 382.200012207031 382.200012207031 382.200012207031 2735.65452398377 2735.65452398377 2735.65452398377 1 1 0 2483 Inf -1 0.5
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lecorguille
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3040 M382T3490 382.200012207031 382.200012207031 382.200012207031 3490.10642571042 3490.10642571042 3490.10642571042 1 1 0 [M-H+NaCOOH]- 315.227 [M-H-C3H2O3]- 469.208 31 1.12312713887978 -1.078074098101 0.395151804512359
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lecorguille
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3041 M382T3218 382.200012207031 382.200012207031 382.200012207031 3217.78886318599 3217.78886318599 3217.78886318599 1 1 0 113 2.18037951298872 0.789822481599993 0.513183050104039
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lecorguille
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3042 M382T3184 382.200012207031 382.200012207031 382.200012207031 3184.44736675265 3184.44736675265 3184.44736675265 1 1 0 40 1.66947081943591 0.621755616008731 0.624631030061633
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lecorguille
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3043 M382T3796 382.300018310547 382.300018310547 382.300018310547 3795.53016040064 3795.53016040064 3795.53016040064 1 0 1 5404 Inf 1 0.5
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lecorguille
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3044 M382T4128 382.399993896484 382.399993896484 382.399993896484 4128.36599789849 4128.36599789849 4128.36599789849 1 1 0 1490 1.24857456926677 -0.240936181603571 0.842999516383448
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lecorguille
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3045 M383T4139 383 383 383 4139.39602511555 4139.39602511555 4139.39602511555 1 1 0 4222 26.0923349054837 -1.25639162536329 0.427183889232304
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lecorguille
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3046 M383T3254 383.100006103516 383.100006103516 383.100006103516 3253.51430490962 3253.51430490962 3253.51430490962 1 0 1 34 2.13799680434001 -1.20069134254071 0.359140638246207
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lecorguille
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3047 M383T3813 383.100006103516 383.100006103516 383.100006103516 3813.40975648734 3813.40975648734 3813.40975648734 1 0 1 2373 2.11313425263563 1.87011727363936 0.216026072203701
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lecorguille
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3048 M383T3599 383.100006103516 383.100006103516 383.100006103516 3599.35782419906 3599.35782419906 3599.35782419906 1 0 1 1452 Inf 1 0.5
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lecorguille
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3049 M383T2732 383.200012207031 383.200012207031 383.200012207031 2731.73213489679 2731.73213489679 2731.73213489679 1 1 0 2484 8.19630493490039 -4.07935147499613 0.0672625276179524
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3050 M383T3782 383.200012207031 383.200012207031 383.200012207031 3782.38303955793 3782.38303955793 3782.38303955793 1 1 0 88 1.41459542164723 -1.53403349173591 0.303094268977888
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lecorguille
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3051 M383T4102 383.300018310547 383.300018310547 383.300018310547 4101.61123303705 4101.61123303705 4101.61123303705 1 1 0 216 Inf -1 0.5
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lecorguille
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3052 M383T4049 383.300018310547 383.300018310547 383.300018310547 4049.3439287225 4049.3439287225 4049.3439287225 1 0 1 3425 Inf 2.31311382457185 0.259774241533163
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3053 M383T3356 383.300018310547 383.300018310547 383.300018310547 3355.78665784705 3355.78665784705 3355.78665784705 1 1 0 730 2.66828828849059 -0.585462982363391 0.644769217034876
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3054 M383T3793 383.300018310547 383.300018310547 383.300018310547 3793.37767615419 3793.37767615419 3793.37767615419 1 1 0 5519 6.81480309956682 -0.844219964375271 0.548889959274005
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3055 M383T3518 383.300018310547 383.300018310547 383.300018310547 3518.21662138527 3518.21662138527 3518.21662138527 1 0 1 398 12.9089264527664 1.45681248798877 0.37786761578541
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3056 M384T2948 383.899993896484 383.899993896484 383.899993896484 2948.26058902211 2948.26058902211 2948.26058902211 1 0 1 3186 Inf 1 0.5
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lecorguille
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3057 M384T2699 383.899993896484 383.899993896484 383.899993896484 2698.67460646253 2698.67460646253 2698.67460646253 1 0 1 5070 Inf 1 0.5
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lecorguille
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3058 M384T3308 384 384 384 3308.41925454435 3308.41925454435 3308.41925454435 1 1 0 532 Inf -1 0.5
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lecorguille
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3059 M384T2916 384 384 384 2915.96882550519 2915.96882550519 2915.96882550519 1 1 0 2768 10.732830232314 -1.15128818710363 0.451191056310151
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lecorguille
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3060 M384T4149 384 384 384 4148.84083789786 4148.84083789786 4148.84083789786 1 1 0 6179 Inf -1 0.5
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lecorguille
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3061 M384T4270 384 384 384 4269.75974443202 4269.75974443202 4269.75974443202 1 0 1 332 Inf 1 0.5
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lecorguille
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3062 M384T3135 384 384 384 3134.80387345206 3134.80387345206 3134.80387345206 1 1 0 144 1.24126199428764 -0.151359450091395 0.894134263681247
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lecorguille
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3063 M384T3496 384.100006103516 384.100006103516 384.100006103516 3495.99683372091 3495.99683372091 3495.99683372091 1 0 1 3504 2.1381444959708 3.33133887524696 0.0833101975491297
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lecorguille
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3064 M384T3121 384.100006103516 384.100006103516 384.100006103516 3121.12587783347 3121.12587783347 3121.12587783347 1 1 0 5086 15.3868000170174 -1.00415104682128 0.497389550260069
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lecorguille
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3065 M384T2829 384.100006103516 384.100006103516 384.100006103516 2829.28403849205 2829.28403849205 2829.28403849205 1 0 1 4578 Inf 3.20684511317984 0.19243555128928
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lecorguille
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3066 M384T4032 384.100006103516 384.100006103516 384.100006103516 4032.24447059459 4032.24447059459 4032.24447059459 1 0 1 3767 1.78067089791021 0.762815408242528 0.576001223179317
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lecorguille
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3067 M384T4143 384.100006103516 384.100006103516 384.100006103516 4142.9532295589 4142.9532295589 4142.9532295589 1 0 1 4223 1.12454046129798 -0.12437857283672 0.9211427082793
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lecorguille
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3068 M384T2600 384.100006103516 384.100006103516 384.100006103516 2599.72397459635 2599.72397459635 2599.72397459635 1 1 0 61 7.60241937974188 -1.09132104702081 0.471252793179563
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lecorguille
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3069 M384T3989 384.200012207031 384.200012207031 384.200012207031 3988.64440792963 3986.89802514914 3990.39079071013 2 1 1 118 5.47232320852167 -3.8814442472655 0.101501322017855
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lecorguille
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3070 M384T3985 384.300018310547 384.300018310547 384.300018310547 3984.57163255824 3979.01348020174 3990.12978491474 2 0 2 4479 2.6055224806868 -0.623351822351829 0.644425840098653
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lecorguille
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3071 M384T3165 384.300018310547 384.300018310547 384.300018310547 3164.66227399556 3164.66227399556 3164.66227399556 1 1 0 832 4.59479560925188 -0.764467011176646 0.575316863422003
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lecorguille
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3072 M384T4083 384.300018310547 384.300018310547 384.300018310547 4083.05475077153 4083.05475077153 4083.05475077153 1 0 1 5723 Inf 1 0.5
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lecorguille
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3073 M384T2608 384.300018310547 384.300018310547 384.300018310547 2607.694668269 2607.694668269 2607.694668269 1 0 1 4012 Inf 1 0.5
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lecorguille
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3074 M384T3349 384.399993896484 384.399993896484 384.399993896484 3349.29618456545 3349.29618456545 3349.29618456545 1 1 0 688 Inf -1 0.5
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lecorguille
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3075 M385T2623 385 385 385 2622.66535661694 2622.66535661694 2622.66535661694 1 0 1 2612 5.39099838059867 0.800844328283322 0.5630214842862
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lecorguille
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3076 M385T4200 385 385 385 4199.77346853085 4199.77346853085 4199.77346853085 1 0 1 198 2.62413497772057 1.30232000225733 0.331487535406735
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lecorguille
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3077 M385T3171 385.100006103516 385.100006103516 385.100006103516 3170.60083826976 3167.64137812471 3173.8247137565 5 2 1 760 1.03390774547946 -0.139237621712618 0.909212748671106
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lecorguille
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3078 M385T2744 385.100006103516 385.100006103516 385.100006103516 2744.27300671808 2744.27300671808 2744.27300671808 1 1 0 4594 4.18588446625328 -1.0653258925786 0.477233236719441
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lecorguille
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3079 M385T3466 385.100006103516 385.100006103516 385.100006103516 3465.60554756889 3465.60554756889 3465.60554756889 1 0 1 4029 1.83438284848911 0.399369792307319 0.737853460215163
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lecorguille
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3080 M385T3650 385.100006103516 385.100006103516 385.100006103516 3649.63197974242 3649.63197974242 3649.63197974242 1 0 1 1536 5.28695948517027 0.810530648128839 0.566204209688873
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lecorguille
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3081 M385T3747 385.100006103516 385.100006103516 385.100006103516 3747.07336244282 3747.07336244282 3747.07336244282 1 1 0 1051 27.5192892124461 -1.01090708004284 0.496158988475942
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3082 M385T3789 385.100006103516 385.100006103516 385.100006103516 3789.28492301941 3789.28492301941 3789.28492301941 1 0 1 4446 3.8439159571306 0.765582428984369 0.572938859718999
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lecorguille
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3083 M385T3546 385.100006103516 385.100006103516 385.100006103516 3546.43288433903 3546.43288433903 3546.43288433903 1 0 1 44 1.19362389379557 0.314562534412232 0.802080678536806
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lecorguille
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3084 M385T3443 385.200012207031 385.200012207031 385.200012207031 3443.44868561462 3438.03540394362 3448.42769567721 4 2 2 [55][M]- [M+Cl]- 350.228 62 1.03099370051415 -0.669482603506438 0.613803745664409
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lecorguille
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3085 M385T4132 385.200012207031 385.200012207031 385.200012207031 4131.55437805172 4126.79074467143 4131.57917077552 3 2 1 [56][M]- [M+Cl]- 350.227 23 1.2910237646513 -0.75589538438861 0.534336217115202
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lecorguille
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3086 M385T3983 385.200012207031 385.200012207031 385.200012207031 3983.01028213959 3983.01028213959 3983.01028213959 2 1 0 118 3.91371282380884 -8.72103169992173 0.0726777727812729
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3087 M385T2967 385.200012207031 385.200012207031 385.200012207031 2966.79559042859 2966.79559042859 2966.79559042859 1 0 1 3234 1.20480057554933 -0.156039009865719 0.890403402944073
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3088 M385T3521 385.300018310547 385.300018310547 385.300018310547 3521.34042635036 3521.34042635036 3521.34042635036 1 0 1 399 5.07437585132297 1.44013888041907 0.346546056421511
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3089 M385T3996 385.300018310547 385.300018310547 385.300018310547 3996.35913389488 3996.35913389488 3996.35913389488 1 0 1 5440 Inf 3.12737763100671 0.197022515025982
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3090 M385T3379 385.300018310547 385.300018310547 385.300018310547 3378.68960817281 3378.68960817281 3378.68960817281 1 1 0 1565 Inf -1 0.5
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lecorguille
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3091 M385T3974 385.300018310547 385.300018310547 385.300018310547 3974.28264461918 3974.28264461918 3974.28264461918 1 0 1 2032 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3092 M385T4166 385.300018310547 385.300018310547 385.300018310547 4165.65555336067 4165.65555336067 4165.65555336067 1 0 1 5917 5.611177291689 1.74109846269934 0.283079219136497
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3093 M385T2828 385.300018310547 385.300018310547 385.300018310547 2827.71461825419 2827.71461825419 2827.71461825419 1 0 1 4579 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3094 M386T3091 386 386 386 3091.14193860861 3091.14193860861 3091.14193860861 1 0 1 5364 Inf 1 0.5
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lecorguille
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3095 M386T2619 386 386 386 2618.649668269 2618.649668269 2618.649668269 1 0 1 2647 1.80733625995449 2.65980214130093 0.158884421959544
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lecorguille
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3096 M386T3024 386 386 386 3023.63722655074 3023.63722655074 3023.63722655074 1 1 0 2121 Inf -1 0.5
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lecorguille
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3097 M386T3647 386.100006103516 386.100006103516 386.100006103516 3646.53531772905 3646.53531772905 3646.53531772905 1 0 1 1537 Inf 1.38748532740247 0.397570680664364
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lecorguille
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3098 M386T3439 386.200012207031 386.200012207031 386.200012207031 3438.75373296649 3438.03540394362 3451.29723481843 3 2 1 [55][M+1]- 62 1.07520518584329 -0.665824510117223 0.625693979694522
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3099 M386T4128 386.200012207031 386.200012207031 386.200012207031 4128.45105340014 4128.45105340014 4128.45105340014 1 0 1 [56][M+1]- 23 1.3563443875369 1.72128825057952 0.333189378381098
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lecorguille
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3100 M386T3175 386.200012207031 386.200012207031 386.200012207031 3175.46440827929 3175.46440827929 3175.46440827929 1 1 0 743 2.51913666115849 -1.16242296444702 0.44952249826904
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3101 M386T3509 386.300018310547 386.300018310547 386.300018310547 3508.73431945504 3508.73431945504 3508.73431945504 1 1 0 119 Inf -1.15401100394072 0.454559246408264
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lecorguille
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3102 M386T3308 386.300018310547 386.300018310547 386.300018310547 3308.41925454435 3308.41925454435 3308.41925454435 1 1 0 533 Inf -1 0.5
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lecorguille
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3103 M386T4136 386.300018310547 386.300018310547 386.300018310547 4136.2093331095 4136.2093331095 4136.2093331095 1 0 1 3976 1.26549630803277 -0.216969523324953 0.858134223201564
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3104 M386T3940 386.300018310547 386.300018310547 386.300018310547 3940.2186903424 3940.2186903424 3940.2186903424 1 1 0 4177 Inf -1 0.5
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lecorguille
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3105 M386T4026 386.300018310547 386.300018310547 386.300018310547 4026.31510272934 4026.31510272934 4026.31510272934 1 0 1 5950 2.88664154662884 1.46551080535541 0.28540788312142
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3106 M386T3520 386.399993896484 386.399993896484 386.399993896484 3519.777977179 3519.777977179 3519.777977179 1 0 1 400 2.7578634482746 0.599224054668019 0.638789404293173
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lecorguille
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3107 M386T4234 386.399993896484 386.399993896484 386.399993896484 4234.43415089905 4234.43415089905 4234.43415089905 1 0 1 212 Inf 1 0.5
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lecorguille
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3108 M386T4149 386.5 386.5 386.5 4148.84083789786 4148.84083789786 4148.84083789786 1 1 0 6180 2.39034081343096 -0.5365860299173 0.666990862650916
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lecorguille
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3109 M387T3113 387 387 387 3113.0638271742 3113.0638271742 3113.0638271742 1 1 0 5344 Inf -1 0.5
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lecorguille
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3110 M387T3141 387 387 387 3141.03863925685 3141.03863925685 3141.03863925685 1 1 0 3119 Inf -3.39293879635966 0.182464595310141
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lecorguille
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3111 M387T2629 387 387 387 2628.99773022353 2628.99773022353 2628.99773022353 1 0 1 2618 1.30262086385879 0.348615102628884 0.774419076636527
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3112 M387T2935 387 387 387 2935.36734798761 2935.36734798761 2935.36734798761 1 1 0 2807 1.03470570035289 0.037266541757222 0.973724885969372
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lecorguille
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3113 M387T2799 387 387 387 2798.53883602715 2798.53883602715 2798.53883602715 1 0 1 3940 1.52629710104256 0.684813242992379 0.604066433130515
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lecorguille
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3114 M387T4182 387.100006103516 387.100006103516 387.100006103516 4181.68550617079 4181.68550617079 4181.68550617079 1 1 0 6005 2.45299652078161 -3.78275537820262 0.121473580277539
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lecorguille
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3115 M387T4221 387.200012207031 387.200012207031 387.200012207031 4220.81451748056 4220.81451748056 4220.81451748056 1 1 0 5986 1.9660759267077 -0.437975230875723 0.716651344584119
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lecorguille
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3116 M387T4206 387.200012207031 387.200012207031 387.200012207031 4205.86975169512 4205.86975169512 4205.86975169512 1 0 1 4920 2.87138123022581 0.61547837788415 0.631877827562282
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lecorguille
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3117 M387T2950 387.200012207031 387.200012207031 387.200012207031 2949.82866539829 2949.82866539829 2949.82866539829 1 0 1 3187 2.49109187180432 0.597021671612482 0.656526153295438
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lecorguille
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3118 M387T3445 387.300018310547 387.300018310547 387.300018310547 3445.3087933556 3445.3087933556 3445.3087933556 1 0 1 2926 Inf 1 0.5
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lecorguille
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diff changeset
3119 M387T3328 387.300018310547 387.300018310547 387.300018310547 3327.72543495697 3327.72543495697 3327.72543495697 1 0 1 1108 1.30670908628067 0.186398889623636 0.870356552799824
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3120 M387T3531 387.300018310547 387.300018310547 387.300018310547 3530.7343473034 3530.7343473034 3530.7343473034 1 0 1 1964 8.29041197100543 0.873050448251257 0.539732337325911
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3121 M387T3385 387.300018310547 387.300018310547 387.300018310547 3384.92104541292 3384.92104541292 3384.92104541292 1 0 1 1566 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3122 M387T4149 387.399993896484 387.399993896484 387.399993896484 4148.8084114526 4148.8084114526 4148.8084114526 1 1 0 289 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3123 M387T4110 387.399993896484 387.399993896484 387.399993896484 4109.63932175949 4109.63932175949 4109.63932175949 1 1 0 2304 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3124 M387T4169 387.399993896484 387.399993896484 387.399993896484 4169.28083065247 4169.28083065247 4169.28083065247 1 1 0 5917 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3125 M387T4063 387.399993896484 387.399993896484 387.399993896484 4063.31637030608 4063.31637030608 4063.31637030608 1 0 1 5797 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
3126 M388T3900 387.899993896484 387.899993896484 387.899993896484 3900.45734732015 3900.45734732015 3900.45734732015 1 1 0 4828 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3127 M388T2528 387.899993896484 387.899993896484 387.899993896484 2527.73597459635 2527.73597459635 2527.73597459635 1 1 0 5596 Inf -1 0.5
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lecorguille
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3128 M388T3331 387.899993896484 387.899993896484 387.899993896484 3330.76303444643 3330.76303444643 3330.76303444643 1 1 0 1109 Inf -1 0.5
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lecorguille
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3129 M388T3883 388 388 388 3883.49697372308 3883.49697372308 3883.49697372308 1 0 1 2216 7.09324381093672 0.957835372033646 0.50746783651359
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lecorguille
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3130 M388T4132 388 388 388 4131.5173144866 4131.5173144866 4131.5173144866 1 1 0 1491 2.41750715735578 -0.711328113898299 0.584351436120816
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lecorguille
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3131 M388T3152 388 388 388 3151.86591620274 3151.86591620274 3151.86591620274 1 0 1 3037 Inf 3.67243628849817 0.169247402375179
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lecorguille
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3132 M388T2606 388 388 388 2606.129668269 2606.129668269 2606.129668269 1 0 1 4013 Inf 2.38485749790416 0.25276557610618
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lecorguille
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3133 M388T3200 388 388 388 3200.25868845643 3200.25868845643 3200.25868845643 1 0 1 1755 1.61157389214674 0.413315691788059 0.733597109022966
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lecorguille
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3134 M388T3726 388 388 388 3726.36186918663 3726.36186918663 3726.36186918663 1 0 1 4678 7.5208285319088 0.859471720978145 0.544026751421472
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lecorguille
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3135 M388T2592 388.100006103516 388.100006103516 388.100006103516 2592.045668269 2592.045668269 2592.045668269 1 0 1 [M-H]- 389.106 61 1.0579333952279 -0.146761757783933 0.901227384283918
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lecorguille
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3136 M388T3728 388.300018310547 388.300018310547 388.300018310547 3728.16712543704 3728.16712543704 3728.16712543704 1 1 0 3564 Inf -1 0.5
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lecorguille
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3137 M388T4065 388.300018310547 388.300018310547 388.300018310547 4065.40128016655 4065.40128016655 4065.40128016655 1 1 0 3886 15.6006928061514 -0.933983486085576 0.520702296729354
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3138 M388T4466 388.300018310547 388.300018310547 388.300018310547 4466.04715089905 4466.04715089905 4466.04715089905 1 0 1 6237 Inf 1 0.5
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lecorguille
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3139 M388T4168 388.300018310547 388.300018310547 388.300018310547 4168.20004725361 4168.20004725361 4168.20004725361 1 0 1 5925 1.42578185996364 -0.420324893924291 0.743916052788845
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3140 M388T3806 388.300018310547 388.300018310547 388.300018310547 3806.17604315607 3806.17604315607 3806.17604315607 1 1 0 4182 5.42918201494218 -0.802314094538944 0.562534045766377
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3141 M388T3502 388.300018310547 388.300018310547 388.300018310547 3502.4895121465 3502.4895121465 3502.4895121465 1 1 0 3376 4.15652060532838 -0.73834641448119 0.584454189533375
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3142 M388T4107 388.300018310547 388.300018310547 388.300018310547 4106.73892937947 4106.73892937947 4106.73892937947 1 0 1 2305 2.86229214447944 1.82481027496947 0.304383416794527
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3143 M389T2872 388.899993896484 388.899993896484 388.899993896484 2872.43169931851 2872.43169931851 2872.43169931851 1 0 1 4762 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3144 M389T3888 388.899993896484 388.899993896484 388.899993896484 3887.79268385776 3887.79268385776 3887.79268385776 1 1 0 2237 1.41581385012174 -0.239889235863978 0.83494036740004
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3145 M389T2641 388.899993896484 388.899993896484 388.899993896484 2641.25838582864 2641.25838582864 2641.25838582864 1 1 0 5667 5.49686112985464 -0.906321411607385 0.521564260856918
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3146 M389T3935 388.899993896484 388.899993896484 388.899993896484 3935.24794838316 3935.24794838316 3935.24794838316 1 0 1 4148 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3147 M389T2619 388.899993896484 388.899993896484 388.899993896484 2618.79628676082 2618.79628676082 2618.79628676082 1 1 0 2648 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3148 M389T2705 389 389 389 2705.14939868583 2704.9751088267 2705.32368854496 2 0 2 136 1.50182414636713 0.491572368214856 0.706924385738088
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3149 M389T3070 389 389 389 3069.65367493135 3069.65367493135 3069.65367493135 1 0 1 2429 4.26444840819835 0.745286096489962 0.581999064380537
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3150 M389T3312 389 389 389 3311.57482024361 3311.57482024361 3311.57482024361 1 1 0 534 Inf -6.29012242516844 0.10036947104536
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3151 M389T3878 389 389 389 3877.89379459742 3877.89379459742 3877.89379459742 1 1 0 2744 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3152 M389T3936 389 389 389 3935.54239794017 3935.54239794017 3935.54239794017 1 1 0 4178 Inf -1 0.5
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lecorguille
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3153 M389T4180 389 389 389 4180.12028828767 4180.12028828767 4180.12028828767 1 1 0 6006 3.10325667578047 -0.645091794134733 0.619694982631694
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3154 M389T3900 389.100006103516 389.100006103516 389.100006103516 3900.16511314389 3900.16511314389 3900.16511314389 1 0 1 4829 6.77649777910801 2.29610353311103 0.216175758181087
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3155 M389T3367 389.100006103516 389.100006103516 389.100006103516 3366.6117655629 3366.6117655629 3366.6117655629 1 1 0 4657 19.443138106666 -1.4053479423435 0.391768565577087
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3156 M389T3351 389.200012207031 389.200012207031 389.200012207031 3350.85695421667 3345.05031410584 3357.10689393243 5 2 2 [57][M]- 7 1.65901461537103 7.75702755071438 0.0749409270620007
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3157 M389T3902 389.300018310547 389.300018310547 389.300018310547 3902.04153788294 3902.04153788294 3902.04153788294 1 1 0 4830 Inf -1.27169951077721 0.424219055179036
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3158 M389T4173 389.300018310547 389.300018310547 389.300018310547 4172.93553468978 4172.93553468978 4172.93553468978 1 0 1 4390 1.91410083192308 0.423277305088352 0.724608722213287
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3159 M389T3520 389.399993896484 389.399993896484 389.399993896484 3519.71194161723 3519.71194161723 3519.71194161723 1 1 0 401 Inf -1 0.5
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lecorguille
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3160 M389T3180 389.399993896484 389.399993896484 389.399993896484 3179.79105992334 3179.79105992334 3179.79105992334 1 0 1 2193 Inf 1 0.5
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lecorguille
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3161 M390T4059 389.800018310547 389.800018310547 389.800018310547 4059.4167690378 4059.4167690378 4059.4167690378 1 0 1 4697 Inf 1 0.5
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lecorguille
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3162 M390T3912 390 390 390 3911.55024985287 3911.55024985287 3911.55024985287 1 1 0 4831 15.0255281961621 -0.931386158262291 0.521510158894671
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3163 M390T3528 390 390 390 3527.59982288162 3527.59982288162 3527.59982288162 1 0 1 402 12.1681336563915 1.05226292542135 0.481349899304895
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3164 M390T3095 390 390 390 3094.51071553496 3094.51071553496 3094.51071553496 1 1 0 5365 Inf -1 0.5
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lecorguille
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3165 M390T2993 390 390 390 2992.73344612949 2992.73344612949 2992.73344612949 1 1 0 32 1.08290465154112 -0.115761808821863 0.920259241756539
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3166 M390T3376 390.100006103516 390.100006103516 390.100006103516 3375.58219226441 3375.58219226441 3375.58219226441 1 0 1 1567 Inf 1 0.5
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lecorguille
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3167 M390T4179 390.100006103516 390.100006103516 390.100006103516 4179.24904985862 4179.24904985862 4179.24904985862 1 0 1 4391 2.1956114084112 0.618760956142639 0.610701699046394
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lecorguille
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3168 M390T3350 390.200012207031 390.200012207031 390.200012207031 3349.70355123946 3344.60570447021 3352.47916777515 4 2 2 [57][M+1]- 7 1.04178174374782 -0.234746250280995 0.844622745342127
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3169 M390T2985 390.200012207031 390.200012207031 390.200012207031 2984.56069227344 2984.56069227344 2984.56069227344 1 0 1 4629 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3170 M390T3814 390.200012207031 390.200012207031 390.200012207031 3814.21237980294 3814.21237980294 3814.21237980294 1 1 0 46 6.13031438269338 -0.926997127141568 0.523011309529074
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3171 M390T3123 390.200012207031 390.200012207031 390.200012207031 3122.69683788133 3122.69683788133 3122.69683788133 1 1 0 5078 1.14117164020161 -0.198049437334811 0.869059082221701
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3172 M390T3678 390.300018310547 390.300018310547 390.300018310547 3677.76126309236 3677.76126309236 3677.76126309236 1 0 1 3691 1.32377641163054 -0.195159948211588 0.864477801008511
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3173 M390T3448 390.300018310547 390.300018310547 390.300018310547 3448.36471818838 3448.36471818838 3448.36471818838 1 0 1 2927 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3174 M390T3429 390.300018310547 390.300018310547 390.300018310547 3428.5072600218 3428.5072600218 3428.5072600218 1 1 0 5266 Inf -1 0.5
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lecorguille
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3175 M390T4111 390.300018310547 390.300018310547 390.300018310547 4111.04941480277 4111.04941480277 4111.04941480277 1 1 0 43 5.22283515228858 -2.07002657928911 0.284456562957762
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3176 M390T3135 390.300018310547 390.300018310547 390.300018310547 3134.57459104471 3134.57459104471 3134.57459104471 1 0 1 144 2.39751832622784 0.779072849033458 0.527389248870555
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3177 M390T3181 390.300018310547 390.300018310547 390.300018310547 3181.37964662454 3181.37964662454 3181.37964662454 1 0 1 2194 3.19654828629027 1.19967308358288 0.369640695336108
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3178 M390T3542 390.399993896484 390.399993896484 390.399993896484 3541.9990379483 3541.9990379483 3541.9990379483 1 1 0 2340 1.85140070553137 -0.404618437460328 0.734914047079938
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3179 M391T3329 391 391 391 3329.2716485188 3322.77149725563 3332.3332359794 3 1 2 [M+Cl+NH3]- 339.006 15 2.09503065504996 0.804776646035532 0.505881765187537
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lecorguille
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3180 M391T4144 391 391 391 4143.9632134336 4143.9632134336 4143.9632134336 1 0 1 5830 3.30775360769994 1.17603359644961 0.383490797986503
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3181 M391T3511 391 391 391 3510.94211515955 3510.94211515955 3510.94211515955 1 1 0 4524 Inf -1 0.5
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lecorguille
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3182 M391T2711 391 391 391 2710.92356693602 2710.92356693602 2710.92356693602 1 1 0 2485 Inf -1 0.5
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lecorguille
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3183 M391T3287 391 391 391 3286.53442458847 3286.53442458847 3286.53442458847 1 1 0 3795 1.59408037178797 -0.315701455661522 0.787012345251673
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lecorguille
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3184 M391T3239 391 391 391 3239.20363093946 3239.20363093946 3239.20363093946 1 1 0 80 Inf -1 0.5
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lecorguille
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diff changeset
3185 M391T3627 391.100006103516 391.100006103516 391.100006103516 3627.4123817077 3621.75226325898 3630.7372705795 3 2 1 [58][M]- [M-H]- 392.112 26 1.01421948343146 0.0467485975036706 0.969419888087652
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lecorguille
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3186 M391T3633 391.200012207031 391.200012207031 391.200012207031 3632.64692080216 3632.64692080216 3632.64692080216 1 1 0 45 4.26161475050246 -1.42881581761004 0.330792106541358
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
3187 M391T3496 391.200012207031 391.200012207031 391.200012207031 3495.99683372091 3495.99683372091 3495.99683372091 1 0 1 3504 1.17431936638412 0.55557134252456 0.644594743677309
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lecorguille
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lecorguille
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diff changeset
3189 M391T3177 391.200012207031 391.200012207031 391.200012207031 3176.86596447828 3176.86596447828 3176.86596447828 1 1 0 749 1.23670189178703 -0.471741155360033 0.689708044743338
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
3190 M391T4173 391.399993896484 391.399993896484 391.399993896484 4172.93553468978 4172.93553468978 4172.93553468978 1 0 1 4392 Inf 3.68955922414804 0.168498189954787
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lecorguille
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3191 M392T4078 391.899993896484 391.899993896484 391.899993896484 4078.279061465 4078.279061465 4078.279061465 1 1 0 3887 Inf -1 0.5
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lecorguille
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3192 M392T3033 392 392 392 3032.9138977851 3032.9138977851 3032.9138977851 1 1 0 2144 Inf -1 0.5
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lecorguille
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3193 M392T2779 392 392 392 2779.49542059808 2779.49542059808 2779.49542059808 1 1 0 4269 2.00400965757531 -0.50071178552059 0.704317106928173
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lecorguille
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3194 M392T3510 392 392 392 3510.29426291687 3510.29426291687 3510.29426291687 1 1 0 4525 Inf -1 0.5
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lecorguille
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3195 M392T3166 392 392 392 3166.07611319354 3166.07611319354 3166.07611319354 1 1 0 833 Inf -1 0.5
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lecorguille
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3196 M392T3628 392.100006103516 392.100006103516 392.100006103516 3627.55483492558 3625.22401983803 3630.45382566854 3 1 2 [58][M+1]- 26 1.53015072686199 0.99511936441655 0.450583945250937
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
3197 M392T3476 392.100006103516 392.100006103516 392.100006103516 3476.22687635508 3476.22687635508 3476.22687635508 1 1 0 [M+Cl]- 357.131 [M-H]- 393.107 31 1.91468428403455 -1.02166691370016 0.414929486659841
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lecorguille
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diff changeset
3198 M392T3492 392.100006103516 392.100006103516 392.100006103516 3491.87515056411 3491.87515056411 3491.87515056411 1 0 1 [M+Cl]- 357.131 [M-H]- 393.107 31 1.50671349951657 0.474310559338576 0.708537664641021
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lecorguille
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3199 M392T2922 392.100006103516 392.100006103516 392.100006103516 2921.83337559875 2921.83337559875 2921.83337559875 1 0 1 2870 6.69044708140149 0.84118883702529 0.549862170910984
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lecorguille
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3200 M392T3455 392.100006103516 392.100006103516 392.100006103516 3454.63966387319 3454.63966387319 3454.63966387319 1 0 1 1273 Inf 1.50394003692995 0.373563698646242
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lecorguille
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diff changeset
3201 M392T2928 392.200012207031 392.200012207031 392.200012207031 2928.43329428729 2928.43329428729 2928.43329428729 1 0 1 [M-H-COCH2]- 435.226 3616 1.94250971411691 1.50981155195206 0.271579114473244
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lecorguille
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3202 M392T3680 392.200012207031 392.200012207031 392.200012207031 3679.76062935955 3679.76062935955 3679.76062935955 1 1 0 3703 1.78164359813712 -1.12501926559633 0.44884061565246
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
3203 M392T3618 392.200012207031 392.200012207031 392.200012207031 3618.26031601074 3618.26031601074 3618.26031601074 1 1 0 2562 12.4550253804964 -10.5251135790562 0.0289091180788541
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3204 M392T3280 392.300018310547 392.300018310547 392.300018310547 3279.90396347494 3279.90396347494 3279.90396347494 1 1 0 1243 3.53686030187907 -1.67820052593724 0.237235780954359
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lecorguille
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3205 M392T2591 392.300018310547 392.300018310547 392.300018310547 2590.62628676082 2590.62628676082 2590.62628676082 1 1 0 2891 Inf -1 0.5
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lecorguille
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3206 M392T3938 392.300018310547 392.300018310547 392.300018310547 3938.01213952227 3938.01213952227 3938.01213952227 1 0 1 4149 6.14659767628363 1.35901486754964 0.381595568561075
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3207 M392T4139 392.399993896484 392.399993896484 392.399993896484 4139.40958781818 4139.40958781818 4139.40958781818 1 1 0 4224 Inf -1 0.5
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lecorguille
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3208 M393T4151 392.899993896484 392.899993896484 392.899993896484 4150.84085356425 4150.84085356425 4150.84085356425 1 0 1 6043 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
3209 M393T2659 392.899993896484 392.899993896484 392.899993896484 2658.87589905919 2658.87589905919 2658.87589905919 1 1 0 4046 11.145937234407 -1.53507479365762 0.359595449453676
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
3210 M393T2847 393 393 393 2846.8195875882 2845.58565258754 2848.05352258887 2 2 0 5523 11.0134527412853 -4.00269500674197 0.102739493744143
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lecorguille
parents:
diff changeset
3211 M393T4129 393 393 393 4129.40661724251 4123.74438860043 4135.06884588458 2 1 1 1492 1.23980310274335 0.150551470253112 0.89468718539716
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lecorguille
parents:
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3212 M393T3317 393 393 393 3316.58199034973 3316.58199034973 3316.58199034973 1 1 0 504 Inf -1 0.5
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lecorguille
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diff changeset
3213 M393T3077 393 393 393 3077.06004455804 3077.06004455804 3077.06004455804 1 0 1 5537 1.82863852605528 0.695612897741152 0.568883023237974
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lecorguille
parents:
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3214 M393T2740 393 393 393 2740.30773275734 2740.30773275734 2740.30773275734 1 1 0 4431 1.77737508581664 -0.381182461571565 0.748174804904343
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3215 M393T3145 393 393 393 3144.8136772185 3144.8136772185 3144.8136772185 1 0 1 3038 Inf 1 0.5
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lecorguille
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3216 M393T3904 393 393 393 3903.6249434652 3903.6249434652 3903.6249434652 1 1 0 4832 3.34069935808469 -0.671234063525071 0.609359666690254
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lecorguille
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3217 M393T3763 393 393 393 3762.71208577947 3762.71208577947 3762.71208577947 1 0 1 984 Inf 1 0.5
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lecorguille
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3218 M393T3778 393 393 393 3778.36705923957 3778.36705923957 3778.36705923957 1 0 1 3674 4.93376105179113 0.781425445309124 0.569527365169552
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lecorguille
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3219 M393T4053 393.100006103516 393.100006103516 393.100006103516 4053.11228761297 4053.11228761297 4053.11228761297 1 0 1 77 1.69888059802921 0.377224684311397 0.754692264032915
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lecorguille
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3220 M393T3280 393.200012207031 393.200012207031 393.200012207031 3279.68868150648 3279.68868150648 3279.68868150648 1 0 1 18 2.63753944577899 6.62441779276402 0.0647073818116646
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lecorguille
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3221 M393T4119 393.200012207031 393.200012207031 393.200012207031 4119.14363200002 4119.14363200002 4119.14363200002 1 0 1 4539 1.95188039652112 0.823770007936915 0.506209092885258
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lecorguille
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3222 M393T3892 393.300018310547 393.300018310547 393.300018310547 3891.96202504143 3891.96202504143 3891.96202504143 1 1 0 4895 80.6218488667232 -0.999846071382123 0.500007250892267
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lecorguille
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3223 M393T3860 393.300018310547 393.300018310547 393.300018310547 3859.92831225415 3859.92831225415 3859.92831225415 1 0 1 1381 Inf 1 0.5
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3224 M393T4034 393.300018310547 393.300018310547 393.300018310547 4033.78549900285 4033.78549900285 4033.78549900285 1 1 0 3768 20.9278738460089 -0.951131629999876 0.515364014524098
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3225 M393T3954 393.300018310547 393.300018310547 393.300018310547 3954.411957813 3954.411957813 3954.411957813 1 1 0 5457 1.28270013223742 0.272447902907344 0.825920319419912
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3226 M394T3297 394 394 394 3296.8379418699 3296.8379418699 3296.8379418699 1 0 1 2603 Inf 1 0.5
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lecorguille
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3227 M394T4053 394 394 394 4052.77255254373 4052.77255254373 4052.77255254373 1 1 0 3409 8.60689908378757 -0.877908488942748 0.538202797347145
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lecorguille
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3228 M394T2652 394 394 394 2651.99291442962 2651.99291442962 2651.99291442962 1 0 1 220 1.75498030468477 1.44281881231377 0.327175114803979
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lecorguille
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3229 M394T3942 394 394 394 3941.5190123983 3941.5190123983 3941.5190123983 1 0 1 [59][M]2- 4150 2.55511817750444 0.729380910784683 0.561376740989132
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3230 M394T4128 394.100006103516 394.100006103516 394.100006103516 4128.36599789849 4128.36599789849 4128.36599789849 1 1 0 23 1.1887870509831 -0.464010626997399 0.707921289594173
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lecorguille
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3233 M394T3973 394.100006103516 394.100006103516 394.100006103516 3972.89371541641 3972.89371541641 3972.89371541641 1 0 1 1987 8.5647916714793 0.877283510767298 0.538399386418007
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lecorguille
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3234 M394T3890 394.200012207031 394.200012207031 394.200012207031 3890.4017301891 3890.4017301891 3890.4017301891 1 1 0 [M+Cl+HCOOH]- 313.212 41 15.2111900487845 -0.995688609017545 0.500731605648275
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3235 M394T2589 394.200012207031 394.200012207031 394.200012207031 2588.76897459635 2588.76897459635 2588.76897459635 1 1 0 2878 Inf -4.47635009136152 0.13992105814042
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3236 M394T3900 394.300018310547 394.300018310547 394.300018310547 3899.75512111057 3899.75512111057 3899.75512111057 1 1 0 4833 5.30370279293176 -0.808530014517126 0.565581529067599
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3237 M394T2724 394.300018310547 394.300018310547 394.300018310547 2723.73277209484 2723.73277209484 2723.73277209484 1 0 1 2486 2.43792504195673 0.699111400227336 0.573671612368861
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3238 M394T2854 394.300018310547 394.300018310547 394.300018310547 2854.33877468858 2854.33877468858 2854.33877468858 1 1 0 4258 Inf -1 0.5
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3239 M394T4098 394.300018310547 394.300018310547 394.300018310547 4098.46503745348 4098.46503745348 4098.46503745348 1 1 0 5100 Inf -1 0.5
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3240 M394T4067 394.300018310547 394.300018310547 394.300018310547 4067.29842537757 4067.29842537757 4067.29842537757 1 1 0 3888 2.07179661781036 -0.465895443881028 0.701929872692358
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3241 M394T3692 394.399993896484 394.399993896484 394.399993896484 3692.39262219716 3692.39262219716 3692.39262219716 1 1 0 5 Inf -1 0.5
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3242 M394T2672 394.399993896484 394.399993896484 394.399993896484 2671.74124426513 2671.74124426513 2671.74124426513 1 0 1 4034 5.12897310364147 0.790151024513448 0.566588533100574
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3243 M394T2812 394.399993896484 394.399993896484 394.399993896484 2812.19233229643 2812.19233229643 2812.19233229643 1 0 1 3295 3.46188204588145 0.683207298038321 0.604750882715957
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3244 M394T3558 394.399993896484 394.399993896484 394.399993896484 3557.96039237637 3557.96039237637 3557.96039237637 1 0 1 1666 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
3245 M394T3943 394.5 394.5 394.5 3943.08690078556 3943.08690078556 3943.08690078556 1 0 1 [59][M+1]2- 4151 8.17907292465461 0.871249062979248 0.540300360109151
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
3246 M395T2710 394.800018310547 394.800018310547 394.800018310547 2710.2502608607 2710.2502608607 2710.2502608607 1 0 1 5876 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
3247 M395T2780 394.899993896484 394.899993896484 394.899993896484 2780.4567769081 2780.4567769081 2780.4567769081 1 1 0 4275 1.71394684176037 -0.56283940976234 0.633134224023057
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
3248 M395T2613 394.899993896484 394.899993896484 394.899993896484 2612.53628676082 2612.53628676082 2612.53628676082 1 1 0 4002 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
3249 M395T3309 395 395 395 3308.58072998214 3308.58072998214 3308.58072998214 1 0 1 535 8.99213688439543 0.883346218445273 0.536494486241192
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
3250 M395T3889 395 395 395 3889.12630150701 3889.12630150701 3889.12630150701 1 0 1 2238 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
3251 M395T3277 395 395 395 3277.08420686365 3277.08420686365 3277.08420686365 1 0 1 1216 2.5835717486742 0.571614182559354 0.650908332866763
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
3252 M395T2967 395 395 395 2967.31573455006 2967.31573455006 2967.31573455006 1 1 0 3231 Inf -1.49613535147545 0.375092454932164
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
3253 M395T3174 395 395 395 3173.8247137565 3173.8247137565 3173.8247137565 1 1 0 775 2.79328696812766 -1.13549454146186 0.377825067003393
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
3254 M395T3948 395.100006103516 395.100006103516 395.100006103516 3948.0247049645 3948.0247049645 3948.0247049645 1 1 0 3736 2.35732842200363 -0.553366515119059 0.66737372877556
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
3255 M395T4138 395.100006103516 395.100006103516 395.100006103516 4137.75932905108 4137.75932905108 4137.75932905108 1 0 1 3952 11.0901335798258 5.88363035654063 0.034560304910102
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
3256 M395T3926 395.100006103516 395.100006103516 395.100006103516 3926.20142216347 3926.20142216347 3926.20142216347 1 1 0 2996 2.73486979359014 -0.595773848180761 0.64027751493519
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
3257 M395T3703 395.200012207031 395.200012207031 395.200012207031 3702.92238284081 3701.23529883703 3704.60946684459 2 1 1 [60][M]- [M+Cl]- 360.231 [M-H]- 396.207 17 1.12967233840829 0.271535793744289 0.831187823553085
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3258 M395T3716 395.200012207031 395.200012207031 395.200012207031 3715.82207492289 3715.67042009322 3715.97372975256 2 1 1 [M+Cl]- 360.231 [M-H]- 396.207 17 1.173725978525 0.272315219805615 0.829852051794977
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3259 M395T2533 395.200012207031 395.200012207031 395.200012207031 2533.42708488001 2533.42708488001 2533.42708488001 1 0 1 5889 2.09829867674861 0.472507504305604 0.698519785599735
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3260 M395T2879 395.200012207031 395.200012207031 395.200012207031 2879.07960746489 2879.07960746489 2879.07960746489 1 1 0 4731 3.65634330699065 -5.0161054012118 0.0402355670817403
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3261 M395T3504 395.300018310547 395.300018310547 395.300018310547 3503.64772709283 3503.64772709283 3503.64772709283 1 0 1 76 1.10607421712424 0.0859064718808039 0.941781934961242
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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3262 M395T3613 395.300018310547 395.300018310547 395.300018310547 3612.97419360995 3612.97419360995 3612.97419360995 1 0 1 2585 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3263 M395T3380 395.300018310547 395.300018310547 395.300018310547 3380.19613943623 3380.19613943623 3380.19613943623 1 0 1 1568 2.32751696035869 1.26418885608482 0.398002933771838
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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3264 M395T3399 395.300018310547 395.300018310547 395.300018310547 3398.73517166064 3398.73517166064 3398.73517166064 1 1 0 484 13.4587588202073 -1.18390303836686 0.443803997766905
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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3265 M395T3200 395.300018310547 395.300018310547 395.300018310547 3200.42770832779 3200.42770832779 3200.42770832779 1 0 1 1744 Inf 4.09415429762398 0.152508803345113
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3266 M395T3978 395.300018310547 395.300018310547 395.300018310547 3977.82980682972 3977.82980682972 3977.82980682972 1 1 0 2073 11.1990434661032 -1.07508279482708 0.476971316173223
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3267 M395T3758 395.300018310547 395.300018310547 395.300018310547 3758.1075428284 3758.1075428284 3758.1075428284 1 0 1 948 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3268 M395T3307 395.399993896484 395.399993896484 395.399993896484 3307.29751813541 3303.02021602721 3311.57482024361 2 1 1 536 2.44725119859931 0.547438331960207 0.661922268712949
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3269 M395T3519 395.399993896484 395.399993896484 395.399993896484 3518.96827050764 3514.40676681436 3523.52977420091 2 1 1 403 1.25118870290425 -0.156825385846273 0.890398949436028
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
3270 M395T4121 395.399993896484 395.399993896484 395.399993896484 4120.69463726928 4120.69463726928 4120.69463726928 1 0 1 1724 Inf 5.30549020127022 0.11860121870689
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3271 M395T3894 395.399993896484 395.399993896484 395.399993896484 3893.85717665056 3893.85717665056 3893.85717665056 1 0 1 4901 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3272 M395T4135 395.399993896484 395.399993896484 395.399993896484 4134.66950325724 4134.66950325724 4134.66950325724 1 1 0 3977 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3273 M395T4091 395.399993896484 395.399993896484 395.399993896484 4091.23433688968 4091.23433688968 4091.23433688968 1 0 1 4978 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3274 M396T3425 395.899993896484 395.899993896484 395.899993896484 3424.98401886254 3424.98401886254 3424.98401886254 1 0 1 871 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3275 M396T2897 396 396 396 2896.66692196751 2896.66692196751 2896.66692196751 1 0 1 [M+Cl+NH3]- 344.006 95 6.62791796481213 5.61270406617515 0.110372880577901
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3276 M396T3396 396 396 396 3395.92903288707 3395.92903288707 3395.92903288707 1 1 0 485 5.75162520399198 -0.813925745936143 0.558705995696858
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
3277 M396T3305 396.100006103516 396.100006103516 396.100006103516 3304.56526850392 3304.56526850392 3304.56526850392 1 0 1 5387 5.36430357028179 1.55888069974147 0.356918364019988
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3278 M396T3337 396.100006103516 396.100006103516 396.100006103516 3337.06159167431 3337.06159167431 3337.06159167431 1 0 1 15 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3279 M396T3747 396.100006103516 396.100006103516 396.100006103516 3747.19950610814 3747.19950610814 3747.19950610814 1 0 1 1032 6.85066262008051 0.845072929635874 0.548616736350316
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3280 M396T3328 396.200012207031 396.200012207031 396.200012207031 3327.51545270666 3327.335343408 3332.36652959154 5 2 2 [61][M]- 15 1.13367920620034 -0.323836137873431 0.796065496774932
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3281 M396T3864 396.200012207031 396.200012207031 396.200012207031 3863.74709060868 3857.79163814401 3863.74709060868 3 2 0 [M-H-CH3]- 412.231 21 6.51085636744037 -4.18570062298176 0.126058603108255
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3282 M396T3705 396.200012207031 396.200012207031 396.200012207031 3705.25436563549 3704.36614312564 3706.14258814535 2 1 1 [60][M+1]- 17 1.07395031908955 0.225665188663365 0.851354427493292
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3283 M396T3721 396.200012207031 396.200012207031 396.200012207031 3720.66621304927 3720.66621304927 3720.66621304927 1 0 1 78 1.18132471009846 0.401732044423564 0.756747287201538
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3284 M396T2867 396.200012207031 396.200012207031 396.200012207031 2866.73738571223 2866.73738571223 2866.73738571223 1 1 0 87 1.1882108709239 -0.1885359038211 0.880213840507789
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3285 M396T4099 396.300018310547 396.300018310547 396.300018310547 4098.66503647187 4098.66503647187 4098.66503647187 2 1 0 150 8.930059348604 -1.03815743670812 0.487728778701685
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3286 M396T3070 396.300018310547 396.300018310547 396.300018310547 3069.85631402629 3069.85631402629 3069.85631402629 1 1 0 2430 5.61440217464427 -0.80915194142206 0.560274971138934
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3287 M396T2646 396.300018310547 396.300018310547 396.300018310547 2646.06874587309 2646.06874587309 2646.06874587309 1 1 0 5940 2.83980007139523 -1.10034450922937 0.454381568311901
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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3288 M396T3867 396.300018310547 396.300018310547 396.300018310547 3867.25281011878 3867.25281011878 3867.25281011878 1 1 0 [M+Cl]- 361.338 21 2.22826228705341 -1.39481409770522 0.324647274843945
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3289 M396T4023 396.399993896484 396.399993896484 396.399993896484 4023.35919511052 4023.35919511052 4023.35919511052 1 1 0 [3M-H+Cl]2- 252.936 185 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3290 M396T4010 396.399993896484 396.399993896484 396.399993896484 4010.00314323252 4010.00314323252 4010.00314323252 1 1 0 5218 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3291 M396T2676 396.399993896484 396.399993896484 396.399993896484 2675.99762877474 2675.99762877474 2675.99762877474 1 0 1 652 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3292 M396T2924 396.399993896484 396.399993896484 396.399993896484 2923.6821033927 2923.6821033927 2923.6821033927 1 1 0 2864 1.1988684189003 -0.127383336434789 0.910620357966585
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3293 M396T4139 396.399993896484 396.399993896484 396.399993896484 4139.40958781818 4139.40958781818 4139.40958781818 1 1 0 4225 2.58498801367109 -0.605675240384528 0.649399844150233
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3294 M396T3900 396.5 396.5 396.5 3900.16511314389 3900.16511314389 3900.16511314389 1 0 1 4834 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3295 M397T3305 396.899993896484 396.899993896484 396.899993896484 3305.26188051509 3305.26188051509 3305.26188051509 1 1 0 537 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3296 M397T2520 396.899993896484 396.899993896484 396.899993896484 2519.91097459635 2519.91097459635 2519.91097459635 1 1 0 147 1.70244151588498 -0.488147086921283 0.673767814757632
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3297 M397T2662 396.899993896484 396.899993896484 396.899993896484 2662.24329763045 2662.24329763045 2662.24329763045 1 0 1 2265 4.13068456318622 0.73663054121793 0.585064430691331
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3298 M397T3916 397 397 397 3916.30780579745 3916.30780579745 3916.30780579745 1 1 0 5140 1.10779784703068 -0.0722318788074519 0.949051350648928
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3299 M397T3289 397 397 397 3289.43873665169 3289.43873665169 3289.43873665169 1 1 0 2110 1.30822192112975 0.187181600223521 0.869830197970126
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3300 M397T4023 397 397 397 4022.90524572317 4022.90524572317 4022.90524572317 1 0 1 5575 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3301 M397T3024 397 397 397 3024.10539557223 3024.10539557223 3024.10539557223 1 0 1 2129 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3302 M397T3400 397 397 397 3400.21216836929 3400.21216836929 3400.21216836929 1 0 1 1323 1.0185124241072 0.0129696602007356 0.990829801765614
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3303 M397T3820 397 397 397 3819.73488646232 3819.73488646232 3819.73488646232 1 0 1 1883 7.19312430994229 0.85277697058155 0.546155821827288
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3304 M397T3054 397.100006103516 397.100006103516 397.100006103516 3053.908743692 3053.908743692 3053.908743692 1 0 1 3478 1.72105829341155 0.926642589661782 0.476702189832472
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3305 M397T2720 397.200012207031 397.200012207031 397.200012207031 2720.18669043818 2720.18669043818 2720.18669043818 1 1 0 2487 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3306 M397T3324 397.200012207031 397.200012207031 397.200012207031 3324.18480679452 3324.18480679452 3324.18480679452 1 1 0 [61][M+1]- 15 1.35746981429669 -0.638288321371284 0.594842581631396
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3307 M397T2872 397.200012207031 397.200012207031 397.200012207031 2872.09955249099 2872.09955249099 2872.09955249099 1 1 0 4759 6.27969768360231 -1.7918425701081 0.3187967975587
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
3308 M397T3595 397.300018310547 397.300018310547 397.300018310547 3594.93424394033 3594.93424394033 3594.93424394033 1 0 1 1453 6.88600604693437 0.845904645915694 0.548350469353861
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
3309 M397T2879 397.300018310547 397.300018310547 397.300018310547 2878.89532842224 2878.89532842224 2878.89532842224 1 0 1 4732 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
3310 M397T4144 397.399993896484 397.399993896484 397.399993896484 4144.11906198033 4144.11906198033 4144.11906198033 1 1 0 5831 7.57461084122297 -0.860513348019795 0.543696232582406
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3311 M397T3997 397.399993896484 397.399993896484 397.399993896484 3997.30497933253 3997.30497933253 3997.30497933253 1 1 0 5441 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
3312 M398T2921 397.800018310547 397.800018310547 397.800018310547 2920.59039378074 2920.59039378074 2920.59039378074 1 1 0 60 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3313 M398T3889 398 398 398 3889.12630150701 3889.12630150701 3889.12630150701 1 0 1 2239 1.99081391752713 0.444738864338033 0.713037476857564
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
3314 M398T2537 398 398 398 2536.55708488001 2536.55708488001 2536.55708488001 1 0 1 5779 1.16095749423155 -0.157147135516661 0.893811286481207
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3315 M398T4139 398 398 398 4139.39602511555 4139.39602511555 4139.39602511555 1 1 0 4226 Inf -1.50372647802892 0.373605383520139
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
3316 M398T3661 398.100006103516 398.100006103516 398.100006103516 3660.89835860805 3660.89835860805 3660.89835860805 1 0 1 446 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
3317 M398T4102 398.100006103516 398.100006103516 398.100006103516 4101.80079484156 4101.80079484156 4101.80079484156 1 1 0 5811 1.59889386679293 -0.317570976002632 0.785868722582561
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
3318 M398T4133 398.100006103516 398.100006103516 398.100006103516 4133.14561853743 4133.14561853743 4133.14561853743 1 1 0 1493 Inf -1.83550861925991 0.317576745780816
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3319 M398T3552 398.100006103516 398.100006103516 398.100006103516 3551.63834287452 3551.63834287452 3551.63834287452 1 1 0 2320 2.75016792359401 -0.745133795074393 0.56982776595364
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
3320 M398T4024 398.100006103516 398.100006103516 398.100006103516 4024.27788947618 4024.27788947618 4024.27788947618 1 1 0 185 1.57139681267718 -0.536578429813682 0.653315030485453
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
3321 M398T3461 398.200012207031 398.200012207031 398.200012207031 3460.67099542738 3460.67099542738 3460.67099542738 1 1 0 [M-2H+Na]- 377.212 19 3.00725547691583 -0.654928591665893 0.61581000727127
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3322 M398T4045 398.200012207031 398.200012207031 398.200012207031 4045.23109118292 4045.23109118292 4045.23109118292 1 0 1 106 1.71258900841023 -0.725600121125831 0.554896269502624
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
3323 M398T3656 398.200012207031 398.200012207031 398.200012207031 3655.95337951855 3655.95337951855 3655.95337951855 1 1 0 47 11.272406812642 -1.02052251495201 0.493319152809832
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3324 M398T3409 398.200012207031 398.200012207031 398.200012207031 3409.47570356272 3409.47570356272 3409.47570356272 1 0 1 2547 1.09563642244657 0.0676188727710764 0.952302096401472
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3325 M398T3389 398.200012207031 398.200012207031 398.200012207031 3389.42833570345 3389.42833570345 3389.42833570345 1 0 1 461 11.649791800207 0.934933939733562 0.520423000738706
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
3326 M398T4054 398.300018310547 398.300018310547 398.300018310547 4054.00220415312 4049.61097536975 4059.45392694636 3 2 1 [M-H-COCH2]- 441.31 77 17.740416891169 -4.25235805679641 0.123824748291033
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
3327 M398T2861 398.300018310547 398.300018310547 398.300018310547 2860.80154663963 2860.80154663963 2860.80154663963 1 0 1 3638 4.35352737099907 1.87448391528047 0.219207582122267
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
3328 M398T3891 398.300018310547 398.300018310547 398.300018310547 3891.34438369106 3891.34438369106 3891.34438369106 1 0 1 4902 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
3329 M398T3945 398.399993896484 398.399993896484 398.399993896484 3944.90023893685 3944.90023893685 3944.90023893685 1 1 0 3737 6.32162379327197 -0.831474005785515 0.55299220999949
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3330 M398T3571 398.399993896484 398.399993896484 398.399993896484 3571.09002855495 3571.09002855495 3571.09002855495 1 1 0 1642 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3331 M398T3188 398.399993896484 398.399993896484 398.399993896484 3187.97882224249 3187.97882224249 3187.97882224249 1 1 0 2195 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3332 M399T3288 399 399 399 3287.55118520376 3287.55118520376 3287.55118520376 1 0 1 2111 Inf 1 0.5
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lecorguille
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3333 M399T3939 399 399 399 3938.65939353942 3938.65939353942 3938.65939353942 1 1 0 4127 Inf -1.50951922366074 0.372477591230611
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3334 M399T2800 399.100006103516 399.100006103516 399.100006103516 2799.83938196203 2799.49239024527 2800.18637367879 2 1 1 98 1.05124887072594 0.0532182542337498 0.962454468658792
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3335 M399T3142 399.100006103516 399.100006103516 399.100006103516 3141.63273957229 3141.63273957229 3141.63273957229 1 0 1 3110 1.74252225431464 4.65371763085684 0.115005188574214
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
3336 M399T4149 399.200012207031 399.200012207031 399.200012207031 4148.8084114526 4148.8084114526 4148.8084114526 1 1 0 6181 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3337 M399T2854 399.200012207031 399.200012207031 399.200012207031 2854.33877468858 2854.33877468858 2854.33877468858 1 1 0 4259 2.42941057565217 -3.54780728078651 0.173573099789267
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3338 M399T2810 399.200012207031 399.200012207031 399.200012207031 2809.97239569454 2809.97239569454 2809.97239569454 1 1 0 202 1.56031644721336 -0.302340330537646 0.795242081090513
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
3339 M399T4048 399.300018310547 399.300018310547 399.300018310547 4048.02955084935 4048.02955084935 4062.59184049356 3 2 0 4115 23.3588706523741 -1.77851332124658 0.325565727428818
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3340 M399T2869 399.300018310547 399.300018310547 399.300018310547 2869.20355392318 2869.20355392318 2869.20355392318 1 0 1 3647 3.02344042662242 0.635398111519312 0.623625983514867
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
3341 M399T2753 399.300018310547 399.300018310547 399.300018310547 2752.51801993109 2752.51801993109 2752.51801993109 1 0 1 4352 Inf 1.65095237863251 0.346708335320537
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3342 M399T3748 399.300018310547 399.300018310547 399.300018310547 3747.93808446807 3747.93808446807 3747.93808446807 1 1 0 1052 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3343 M399T3169 399.300018310547 399.300018310547 399.300018310547 3169.04072732697 3169.04072732697 3169.04072732697 1 0 1 776 6.79206153636092 1.14718663196524 0.445060110614414
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3344 M399T3331 399.300018310547 399.300018310547 399.300018310547 3330.76303444643 3330.76303444643 3330.76303444643 1 1 0 1110 2.81840988969856 -0.608050463802239 0.635016125961537
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3345 M399T2726 399.300018310547 399.300018310547 399.300018310547 2726.48521210177 2726.48521210177 2726.48521210177 1 0 1 2488 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3346 M399T4116 399.399993896484 399.399993896484 399.399993896484 4115.90921963138 4115.90921963138 4115.90921963138 2 1 0 2306 3.74525047297265 -0.708185875901741 0.595374687980033
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3347 M400T2877 399.800018310547 399.800018310547 399.800018310547 2876.8071344984 2876.8071344984 2876.8071344984 1 1 0 4733 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3348 M400T2700 399.899993896484 399.899993896484 399.899993896484 2700.3977849365 2700.3977849365 2700.3977849365 1 0 1 136 3.8444517624085 44.2796793740201 0.000513405893727059
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3349 M400T2885 399.899993896484 399.899993896484 399.899993896484 2885.36146766203 2885.36146766203 2885.36146766203 1 0 1 5660 3.4413348741727 0.681236229954648 0.605504365305692
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3350 M400T2521 399.899993896484 399.899993896484 399.899993896484 2521.47597459635 2521.47597459635 2521.47597459635 1 1 0 5051 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3351 M400T2591 399.899993896484 399.899993896484 399.899993896484 2590.62628676082 2590.62628676082 2590.62628676082 1 1 0 2892 2.42493278327503 -0.543238726279677 0.66387448601805
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3352 M400T3274 400 400 400 3273.83909095546 3273.83909095546 3273.83909095546 1 1 0 [M-H-CH4]- 417.033 145 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3353 M400T4246 400 400 400 4246.28574443202 4246.28574443202 4246.28574443202 1 0 1 326 Inf 2.46627565982419 0.245234025325714
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lecorguille
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3354 M400T3555 400 400 400 3555.18495297117 3555.18495297117 3555.18495297117 1 1 0 186 3.02563774805626 -1.59606560015207 0.258597384920376
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lecorguille
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3355 M400T3795 400 400 400 3794.94888137568 3794.94888137568 3794.94888137568 1 1 0 5405 Inf -1 0.5
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lecorguille
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3356 M400T2780 400.100006103516 400.100006103516 400.100006103516 2779.82243206612 2777.62270382815 2782.0221603041 2 1 1 112 1.27733555230096 -0.41394112508734 0.749521978827588
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3357 M400T4229 400.100006103516 400.100006103516 400.100006103516 4228.96022276304 4228.96022276304 4228.96022276304 1 1 0 5422 Inf -1.10912544655547 0.467090850409481
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lecorguille
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3358 M400T4086 400.100006103516 400.100006103516 400.100006103516 4086.12110918763 4086.12110918763 4086.12110918763 1 1 0 4979 51.7476674779967 -0.980492398045952 0.506173205737115
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3359 M400T3927 400.100006103516 400.100006103516 400.100006103516 3927.40977769388 3927.40977769388 3927.40977769388 1 0 1 2956 Inf 1.21903254094576 0.437364495755912
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lecorguille
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3360 M400T3450 400.100006103516 400.100006103516 400.100006103516 3449.98429869677 3449.98429869677 3449.98429869677 1 0 1 [M-H-COCH2]- 443.11 74 1.09323817021592 -0.0629302841233888 0.955585589836258
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3361 M400T2802 400.100006103516 400.100006103516 400.100006103516 2801.7784139276 2801.7784139276 2801.7784139276 1 1 0 5175 1.10785817322146 0.321388296482622 0.789143376804286
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3362 M400T4330 400.100006103516 400.100006103516 400.100006103516 4330.36340158956 4330.36340158956 4330.36340158956 1 1 0 6119 42.1184210526351 -2.39424240233025 0.250522372102746
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3363 M400T3821 400.200012207031 400.200012207031 400.200012207031 3820.6283012824 3819.00645257292 3822.25014999188 2 1 1 [62][M]- 1866 1.05116891123303 0.0354468527641635 0.974949138304042
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lecorguille
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3364 M400T4449 400.200012207031 400.200012207031 400.200012207031 4449.30040158956 4449.30040158956 4449.30040158956 1 1 0 258 5.57629629629706 -1.08345788712306 0.459084960185751
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lecorguille
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3365 M400T4462 400.200012207031 400.200012207031 400.200012207031 4462.24874443202 4462.24874443202 4462.24874443202 1 0 1 5900 2.98159509202448 -0.660862488850085 0.626231732805632
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3366 M400T4136 400.200012207031 400.200012207031 400.200012207031 4136.24529906271 4136.24529906271 4136.24529906271 1 1 0 99 51.35520485105 -1.12277312029811 0.463150920895288
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lecorguille
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3367 M400T4116 400.200012207031 400.200012207031 400.200012207031 4115.77010394063 4115.77010394063 4115.77010394063 1 1 0 43 36.8365661658573 -1.15397155531866 0.454520214101594
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3368 M400T3744 400.200012207031 400.200012207031 400.200012207031 3744.08158908687 3744.08158908687 3744.08158908687 1 0 1 [M-H]- 401.212 [M-H-CO2]- 445.205 14 95.9555053365036 1.00094788091685 0.499689705541168
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3369 M400T3856 400.200012207031 400.200012207031 400.200012207031 3855.84399832511 3855.84399832511 3855.84399832511 1 1 0 21 1.69279898103758 -0.354567947098627 0.763608627702838
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3370 M400T4176 400.200012207031 400.200012207031 400.200012207031 4175.56395558154 4175.56395558154 4175.56395558154 1 1 0 115 118.325720846012 -1.06485288204224 0.480001770769116
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3372 M400T3101 400.300018310547 400.300018310547 400.300018310547 3100.55606876356 3100.55606876356 3100.55606876356 1 0 1 3137 Inf 2.20023452293926 0.271573934417922
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3373 M400T4069 400.300018310547 400.300018310547 400.300018310547 4068.87273440628 4068.87273440628 4068.87273440628 1 0 1 3853 2.62974904638211 0.579267766900154 0.647500383408103
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3375 M400T3691 400.300018310547 400.300018310547 400.300018310547 3690.86797846772 3690.86797846772 3690.86797846772 1 0 1 596 Inf 1 0.5
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3376 M400T3024 400.300018310547 400.300018310547 400.300018310547 3024.20132472852 3024.20132472852 3024.20132472852 1 0 1 2145 Inf 1 0.5
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3377 M400T3943 400.300018310547 400.300018310547 400.300018310547 3942.74331488216 3942.74331488216 3942.74331488216 1 0 1 4152 3.2216637483672 2.22056795381908 0.268984558945025
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3378 M400T3620 400.300018310547 400.300018310547 400.300018310547 3620.19051163634 3620.19051163634 3620.19051163634 1 1 0 2561 Inf -1 0.5
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3379 M400T2655 400.300018310547 400.300018310547 400.300018310547 2655.1439483562 2655.1439483562 2655.1439483562 1 1 0 220 3.06116094572167 -3.45871494176302 0.146887709832079
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3380 M400T4214 400.5 400.5 400.5 4213.60166691331 4213.60166691331 4213.60166691331 1 0 1 5320 Inf 1 0.5
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3381 M401T2715 401 401 401 2715.49873528923 2710.92356693602 2720.07390364244 2 1 1 2489 1.84298462498857 -0.610134847555244 0.603987720698948
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3382 M401T4074 401 401 401 4073.59947604232 4073.59947604232 4073.59947604232 1 0 1 3889 Inf 1 0.5
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3383 M401T3404 401 401 401 3403.71195310584 3403.71195310584 3403.71195310584 1 1 0 1324 2.71517928727318 0.592774842095397 0.641577066605215
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3384 M401T3131 401 401 401 3130.53852274587 3130.53852274587 3130.53852274587 1 1 0 4996 2.8072529525966 -0.60645153250025 0.635696097270168
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3385 M401T3332 401.100006103516 401.100006103516 401.100006103516 3332.33894932124 3330.76303444643 3333.91486419605 2 1 1 [M-2H+Na]- 380.112 15 1.31791657453799 -1.00336115307435 0.491553714084083
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3386 M401T3773 401.100006103516 401.100006103516 401.100006103516 3772.51799575719 3772.51799575719 3772.51799575719 1 1 0 985 3.19379100202712 -0.911892297930605 0.491251724948467
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lecorguille
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3387 M401T3550 401.100006103516 401.100006103516 401.100006103516 3550.11811785475 3550.11811785475 3550.11811785475 1 0 1 2341 1.24259518642398 -0.216766172152842 0.864104141742959
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3388 M401T3742 401.200012207031 401.200012207031 401.200012207031 3742.33047859757 3740.56103194088 3745.64062703048 3 1 2 [63][M]- 14 4.3164285004525 0.891288313271373 0.532988280954135
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lecorguille
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3389 M401T3829 401.200012207031 401.200012207031 401.200012207031 3828.68097474065 3828.68097474065 3828.68097474065 1 1 0 [62][M+1]- 1855 1.02096247810547 0.0157122657559939 0.988890811930516
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
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3390 M401T2742 401.200012207031 401.200012207031 401.200012207031 2741.86048341076 2741.86048341076 2741.86048341076 1 1 0 122 4.21384990805423 -1.14277707213582 0.456240607768196
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3391 M401T4222 401.300018310547 401.300018310547 401.300018310547 4222.37999984997 4222.37999984997 4222.37999984997 1 1 0 5987 Inf -2.09746374053051 0.283224803743957
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3392 M401T4012 401.300018310547 401.300018310547 401.300018310547 4012.37149285916 4012.37149285916 4012.37149285916 1 1 0 5219 Inf -1 0.5
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3393 M401T4186 401.300018310547 401.300018310547 401.300018310547 4185.56402825899 4185.56402825899 4185.56402825899 1 0 1 6062 Inf 1 0.5
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lecorguille
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3394 M401T4146 401.300018310547 401.300018310547 401.300018310547 4146.10802128113 4146.10802128113 4146.10802128113 1 0 1 5615 1.55559845860553 0.553263262900968 0.677049104134027
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3395 M402T2790 401.899993896484 401.899993896484 401.899993896484 2789.52257744508 2789.52257744508 2789.52257744508 1 0 1 913 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3396 M402T3377 401.899993896484 401.899993896484 401.899993896484 3377.12051467197 3377.12051467197 3377.12051467197 1 0 1 1569 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3397 M402T3096 402 402 402 3096.05443717193 3096.05443717193 3096.05443717193 1 1 0 5366 1.66953899927713 -0.344038905888569 0.769892149282128
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lecorguille
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3398 M402T3449 402 402 402 3449.18585347227 3449.18585347227 3449.18585347227 1 1 0 3337 Inf -1 0.5
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3399 M402T3642 402 402 402 3641.98261419017 3641.98261419017 3641.98261419017 1 1 0 1522 Inf -1 0.5
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lecorguille
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3400 M402T2684 402.100006103516 402.100006103516 402.100006103516 2684.06586984756 2684.06586984756 2684.06586984756 1 0 1 [M-H+NaCOOH]- 335.127 6 1.12108411327777 0.76471238916943 0.531718913140346
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lecorguille
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3401 M402T2748 402.200012207031 402.200012207031 402.200012207031 2748.03095547446 2748.03095547446 2748.03095547446 1 0 1 4353 Inf 1 0.5
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lecorguille
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3402 M402T2636 402.200012207031 402.200012207031 402.200012207031 2636.11486336154 2636.11486336154 2636.11486336154 1 0 1 2649 1.1445312240349 -0.111284542908077 0.921861408161809
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3403 M402T2727 402.200012207031 402.200012207031 402.200012207031 2726.84116695942 2726.84116695942 2726.84116695942 1 0 1 2452 2.9220510150673 0.62233976533412 0.629008669817041
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3404 M402T3742 402.200012207031 402.200012207031 402.200012207031 3742.33047859757 3742.33047859757 3742.33047859757 1 1 0 [63][M+1]- 14 2.00187277935026 0.689994086411245 0.593401693659969
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lecorguille
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3405 M402T4288 402.300018310547 402.300018310547 402.300018310547 4288.42822276304 4288.42822276304 4288.42822276304 1 1 0 290 8.74358974358905 -0.879894516228095 0.537578430475978
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
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3406 M402T2834 402.300018310547 402.300018310547 402.300018310547 2834.00867854187 2834.00867854187 2834.00867854187 1 0 1 4580 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
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3407 M402T3404 402.300018310547 402.300018310547 402.300018310547 3403.71195310584 3403.71195310584 3403.71195310584 1 1 0 1325 2.56539136494568 -1.56203146418603 0.361003909667766
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3408 M402T3761 402.300018310547 402.300018310547 402.300018310547 3761.35736156645 3761.35736156645 3761.35736156645 1 1 0 986 Inf -1 0.5
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lecorguille
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3409 M403T2721 402.899993896484 402.899993896484 402.899993896484 2720.83974673694 2720.83974673694 2720.83974673694 1 1 0 2490 Inf -1 0.5
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lecorguille
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3410 M403T3542 403 403 403 3542.25335219816 3540.90357804154 3543.60312635477 2 2 0 2322 7.79961114811878 -4.33568312349983 0.0523949477071741
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3411 M403T3952 403 403 403 3952.49471087683 3952.49471087683 3952.49471087683 1 0 1 5458 Inf 1 0.5
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lecorguille
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3412 M403T3276 403 403 403 3275.5084930437 3275.5084930437 3275.5084930437 1 0 1 5015 2.78887604163726 0.641332213693328 0.63690843360342
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
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3413 M403T3616 403 403 403 3616.14153100784 3616.14153100784 3616.14153100784 1 0 1 2586 Inf 1 0.5
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3414 M403T4105 403.100006103516 403.100006103516 403.100006103516 4105.11785797998 4105.11785797998 4105.11785797998 1 0 1 5651 1.26412501739518 -0.260251989523406 0.819549579626107
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3415 M403T3417 403.100006103516 403.100006103516 403.100006103516 3416.66862409634 3416.66862409634 3416.66862409634 1 0 1 872 1.85916141447875 0.429339245384373 0.718442496768844
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3416 M403T2949 403.100006103516 403.100006103516 403.100006103516 2949.29640186015 2949.29640186015 2949.29640186015 1 1 0 70 1.26602343816674 -1.74321950238611 0.252279402367691
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3417 M403T3874 403.200012207031 403.200012207031 403.200012207031 3874.14513882326 3868.82992309035 3879.46035455616 2 2 0 [M-H+CF3COOH]- 270.212 55 4.37521439053895 -0.852226446618038 0.541135128498305
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3418 M403T2741 403.200012207031 403.200012207031 403.200012207031 2740.77769757478 2740.77769757478 2740.77769757478 1 0 1 4432 8.23402520078684 7.01588861703048 0.0725073415536692
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3419 M403T3432 403.200012207031 403.200012207031 403.200012207031 3432.44528854724 3432.44528854724 3432.44528854724 1 0 1 4916 13.8292721856576 0.943626719496074 0.517099119485517
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3420 M403T2589 403.200012207031 403.200012207031 403.200012207031 2589.06228676082 2589.06228676082 2589.06228676082 1 1 0 2893 1.39242126001484 0.228910008225674 0.842112406484989
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3421 M403T3081 403.300018310547 403.300018310547 403.300018310547 3080.72955073942 3080.72955073942 3080.72955073942 1 0 1 3535 Inf 1.14330256048463 0.457498457498084
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3422 M403T4121 403.300018310547 403.300018310547 403.300018310547 4120.87908209639 4120.87908209639 4120.87908209639 1 0 1 1725 3.00667956227041 -0.633298606848905 0.624484597946285
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3423 M403T3194 403.300018310547 403.300018310547 403.300018310547 3194.01201990731 3194.01201990731 3194.01201990731 1 0 1 1756 Inf 1 0.5
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3424 M403T3902 403.399993896484 403.399993896484 403.399993896484 3902.04153788294 3902.04153788294 3902.04153788294 1 1 0 4835 Inf -1 0.5
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3425 M403T4059 403.399993896484 403.399993896484 403.399993896484 4059.45392694636 4059.45392694636 4059.45392694636 1 1 0 4698 Inf -1 0.5
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3426 M404T3388 403.5 403.5 403.5 3387.92802216455 3387.92802216455 3387.92802216455 1 1 0 486 Inf -1 0.5
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3427 M404T3820 403.800018310547 403.800018310547 403.800018310547 3819.73488646232 3819.73488646232 3819.73488646232 1 0 1 1884 Inf 1 0.5
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3428 M404T2536 403.899993896484 403.899993896484 403.899993896484 2535.707668269 2535.707668269 2535.707668269 1 0 1 5780 2.36779552715666 0.532153492805497 0.669083496633085
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3429 M404T4050 403.899993896484 403.899993896484 403.899993896484 4050.04031536576 4050.04031536576 4050.04031536576 1 1 0 3426 4.0702382161549 -0.732529739445586 0.58652808653697
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3430 M404T4135 403.899993896484 403.899993896484 403.899993896484 4134.65820643842 4134.65820643842 4134.65820643842 1 0 1 3978 Inf 1 0.5
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lecorguille
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3431 M404T3427 403.899993896484 403.899993896484 403.899993896484 3427.45273613588 3427.45273613588 3427.45273613588 1 1 0 5267 5.22858283283711 -0.794345872542935 0.565184813964392
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3432 M404T4121 404 404 404 4120.61108525111 4120.61108525111 4120.61108525111 1 1 0 1726 4.26638252485235 -0.745407205075723 0.581956400401597
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lecorguille
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3433 M404T2676 404 404 404 2675.75151083639 2675.75151083639 2675.75151083639 1 1 0 6 2.81864067433224 -0.608083409499254 0.635002131807074
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lecorguille
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3434 M404T3954 404 404 404 3954.411957813 3954.411957813 3954.411957813 1 1 0 5466 Inf -1.17867826550606 0.447905978229027
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lecorguille
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3435 M404T3574 404 404 404 3573.79058978757 3573.79058978757 3573.79058978757 1 0 1 1667 Inf 1 0.5
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lecorguille
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3436 M404T3904 404.100006103516 404.100006103516 404.100006103516 3904.42566271432 3904.42566271432 3904.42566271432 1 1 0 135 2.73997694722018 -0.621453248236151 0.639065538181551
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3437 M404T2691 404.100006103516 404.100006103516 404.100006103516 2690.57128216482 2690.57128216482 2690.57128216482 1 0 1 6 1.04508800711016 -0.40984827665042 0.722931031806563
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3438 M404T2584 404.200012207031 404.200012207031 404.200012207031 2584.36728676082 2584.36728676082 2584.36728676082 1 1 0 201 18.8768157146366 -0.945698910082661 0.517056533197684
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3439 M404T2740 404.300018310547 404.300018310547 404.300018310547 2740.46846301947 2740.46846301947 2740.46846301947 1 0 1 4433 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3440 M404T3070 404.300018310547 404.300018310547 404.300018310547 3069.65367493135 3069.65367493135 3069.65367493135 1 0 1 2431 9.8296964953393 0.893654917650017 0.533265368110423
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3441 M404T3232 404.300018310547 404.300018310547 404.300018310547 3231.54618911964 3231.54618911964 3231.54618911964 1 0 1 2715 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3442 M404T3705 404.399993896484 404.399993896484 404.399993896484 3705.00880068764 3705.00880068764 3705.00880068764 1 0 1 17 Inf 1 0.5
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lecorguille
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3443 M404T4040 404.399993896484 404.399993896484 404.399993896484 4040.11823531387 4040.11823531387 4040.11823531387 1 1 0 5307 3.47947617501011 -0.944020270093979 0.517997368427573
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lecorguille
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3444 M404T3773 404.399993896484 404.399993896484 404.399993896484 3772.96808530648 3772.96808530648 3772.96808530648 1 1 0 987 Inf -1 0.5
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lecorguille
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3445 M404T4125 404.5 404.5 404.5 4125.3114579078 4125.3114579078 4125.3114579078 1 1 0 1494 Inf -1 0.5
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lecorguille
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3446 M405T3261 404.899993896484 404.899993896484 404.899993896484 3260.74570744212 3260.74570744212 3260.74570744212 1 1 0 3604 Inf -1 0.5
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lecorguille
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3447 M405T2584 404.899993896484 404.899993896484 404.899993896484 2584.220668269 2584.220668269 2584.220668269 1 0 1 5742 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3448 M405T3171 404.899993896484 404.899993896484 404.899993896484 3170.77113798805 3170.77113798805 3170.77113798805 1 1 0 777 Inf -1 0.5
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lecorguille
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3449 M405T4096 405 405 405 4095.88572844587 4095.88572844587 4095.88572844587 1 0 1 5101 5.39254310013564 0.800904203194029 0.563001614051245
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3450 M405T3236 405 405 405 3236.24872401132 3236.24872401132 3236.24872401132 1 0 1 [M-H-H20]- 424.028 54 1.28160956781127 0.17323594566139 0.879240906214624
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3451 M405T3592 405 405 405 3591.77493402246 3591.77493402246 3591.77493402246 1 1 0 1700 2.85077124396868 -0.61262000694064 0.633081502471678
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3452 M405T2925 405.200012207031 405.200012207031 405.200012207031 2924.92540780601 2924.92540780601 2924.92540780601 1 0 1 2871 Inf 1.4073179658315 0.393294612570527
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3453 M405T3717 405.300018310547 405.300018310547 405.300018310547 3716.90805391716 3716.90805391716 3716.90805391716 1 1 0 17 4.42379294663921 -0.754902629039343 0.578630326163003
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3454 M405T3093 405.300018310547 405.300018310547 405.300018310547 3092.7094432471 3092.7094432471 3092.7094432471 1 0 1 166 Inf 1 0.5
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lecorguille
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3455 M405T3703 405.300018310547 405.300018310547 405.300018310547 3703.22405105961 3703.22405105961 3703.22405105961 1 1 0 1179 Inf -1 0.5
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lecorguille
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3456 M405T3437 405.300018310547 405.300018310547 405.300018310547 3437.49117565757 3437.49117565757 3437.49117565757 1 0 1 4884 3.53753295179094 0.690267607663376 0.602068546979778
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3457 M405T3650 405.300018310547 405.300018310547 405.300018310547 3650.36232946302 3650.36232946302 3650.36232946302 1 1 0 1538 Inf -1 0.5
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lecorguille
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3458 M405T3874 405.399993896484 405.399993896484 405.399993896484 3873.56633408971 3873.56633408971 3873.56633408971 1 1 0 2745 Inf -1 0.5
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lecorguille
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3459 M405T4070 405.399993896484 405.399993896484 405.399993896484 4070.44866369949 4070.44866369949 4070.44866369949 1 0 1 3853 1.59651602490793 0.501611101457077 0.684901970133207
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3460 M405T3359 405.399993896484 405.399993896484 405.399993896484 3358.88621166134 3358.88621166134 3358.88621166134 1 1 0 731 3.2835854287176 -0.665286918269642 0.611677529449059
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3461 M406T4083 405.700012207031 405.700012207031 405.700012207031 4082.98442099473 4082.98442099473 4082.98442099473 1 1 0 5736 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3462 M406T3393 405.800018310547 405.800018310547 405.800018310547 3392.55402399013 3392.55402399013 3392.55402399013 1 1 0 500 Inf -1 0.5
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lecorguille
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3463 M406T4072 405.899993896484 405.899993896484 405.899993896484 4072.00465689111 4072.00465689111 4072.00465689111 1 1 0 3890 2.6087019161843 -0.575811142285632 0.649034880706681
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3464 M406T2805 405.899993896484 405.899993896484 405.899993896484 2805.33218699616 2805.33218699616 2805.33218699616 1 1 0 5184 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3465 M406T3173 405.899993896484 405.899993896484 405.899993896484 3173.43617482863 3173.43617482863 3173.43617482863 1 0 1 750 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3466 M406T2849 406 406 406 2848.6929481257 2848.6929481257 2848.6929481257 1 1 0 5633 Inf -1.89499018077914 0.309121493033949
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lecorguille
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3467 M406T3295 406 406 406 3295.29181043493 3295.29181043493 3295.29181043493 1 0 1 2594 4.88233525820901 0.946812438756876 0.502775302101017
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lecorguille
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3468 M406T3619 406 406 406 3618.62698531311 3618.62698531311 3618.62698531311 1 1 0 51 Inf -1 0.5
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lecorguille
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3469 M406T3271 406 406 406 3270.67417547036 3270.67417547036 3270.67417547036 1 1 0 5471 8.0032479600027 -0.868298899347561 0.541231684460917
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3470 M406T3575 406 406 406 3574.63014348789 3574.63014348789 3574.63014348789 1 0 1 1668 1.88537438232062 0.599188116036385 0.638650232687355
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lecorguille
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3471 M406T2928 406.200012207031 406.200012207031 406.200012207031 2928.01486524893 2928.01486524893 2928.01486524893 1 0 1 3618 1.96310345551251 2.36326231068358 0.19114022008384
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3472 M406T2731 406.200012207031 406.200012207031 406.200012207031 2731.49549773349 2731.49549773349 2731.49549773349 1 0 1 2461 1.34490302712671 0.46549401911189 0.695235165170851
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3473 M406T3564 406.200012207031 406.200012207031 406.200012207031 3564.25588593458 3564.25588593458 3564.25588593458 1 0 1 1669 3.30650193280542 2.37563877770331 0.240768709930216
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lecorguille
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3474 M406T4048 406.200012207031 406.200012207031 406.200012207031 4047.7904766663 4047.7904766663 4047.7904766663 1 0 1 4116 1.5750672810331 -0.430627073612019 0.709251106397961
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lecorguille
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3475 M406T3957 406.300018310547 406.300018310547 406.300018310547 3956.93670548455 3956.93670548455 3956.93670548455 1 0 1 5395 8.71400853792348 0.87947017176613 0.537711792322993
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3476 M406T3783 406.300018310547 406.300018310547 406.300018310547 3783.31394298599 3783.31394298599 3783.31394298599 1 0 1 3675 1.8409303749361 0.66932255216165 0.576452818849555
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3477 M406T3088 406.399993896484 406.399993896484 406.399993896484 3088.34051740225 3088.34051740225 3088.34051740225 1 1 0 5954 Inf -1 0.5
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lecorguille
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3478 M406T4076 406.399993896484 406.399993896484 406.399993896484 4076.43189148906 4076.43189148906 4076.43189148906 1 1 0 3852 2.50131745589955 -0.557322107447555 0.657373430386988
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3479 M406T3535 406.399993896484 406.399993896484 406.399993896484 3534.57325439968 3534.57325439968 3534.57325439968 1 1 0 1935 2.65346666783111 -0.583100628197016 0.645807783129238
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lecorguille
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3480 M406T3416 406.399993896484 406.399993896484 406.399993896484 3415.66499188975 3415.66499188975 3415.66499188975 1 0 1 873 2.19924034131464 0.496391233625442 0.686446430964384
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3481 M406T3927 406.5 406.5 406.5 3927.41470965586 3927.41470965586 3927.41470965586 1 1 0 2997 9.00995117306412 -0.883586070922568 0.536419219505915
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3482 M406T3399 406.5 406.5 406.5 3399.03600389222 3399.03600389222 3399.03600389222 1 1 0 1326 Inf -1 0.5
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lecorguille
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3483 M406T3966 406.5 406.5 406.5 3965.53406356649 3965.53406356649 3965.53406356649 1 1 0 2033 Inf -1 0.5
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lecorguille
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3484 M407T2676 406.899993896484 406.899993896484 406.899993896484 2676.4906699159 2676.4906699159 2676.4906699159 1 0 1 6 Inf 18.353634121132 0.0346520435858362
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lecorguille
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3485 M407T2696 406.899993896484 406.899993896484 406.899993896484 2696.11125423261 2696.11125423261 2696.11125423261 1 1 0 148 2.01754084271437 -0.451884761680873 0.709252363103743
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3486 M407T4096 406.899993896484 406.899993896484 406.899993896484 4095.88572844587 4095.88572844587 4095.88572844587 1 0 1 5102 Inf 1 0.5
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lecorguille
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3487 M407T3284 407 407 407 3284.41579069131 3284.41579069131 3284.41579069131 1 0 1 1225 5.27105461170136 4.2565057517815 0.144328567969868
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lecorguille
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3488 M407T3112 407 407 407 3112.43657530524 3112.43657530524 3112.43657530524 1 0 1 5345 5.24727813241008 0.895661107865735 0.534766172808135
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lecorguille
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3489 M407T4088 407 407 407 4087.78237514858 4087.78237514858 4087.78237514858 1 0 1 4980 8.62952187195846 0.878241667913692 0.538098016192335
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3490 M407T3567 407 407 407 3567.4133850825 3567.4133850825 3567.4133850825 1 0 1 1670 Inf 1 0.5
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lecorguille
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3491 M407T3922 407 407 407 3922.2425435536 3922.2425435536 3922.2425435536 1 0 1 2998 4.58784442034254 1.18460738315891 0.415223251593089
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3492 M407T4108 407.100006103516 407.100006103516 407.100006103516 4108.26902823653 4108.26902823653 4108.26902823653 1 0 1 [M+Cl]- 372.127 [M-H-C3H2O3]- 494.106 43 1.73599963619212 0.532018794998208 0.686443558797869
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3493 M407T2708 407.200012207031 407.200012207031 407.200012207031 2708.49212766891 2708.49212766891 2708.49212766891 1 1 0 5877 7.92207768458586 -15.2275502389651 0.013981284344907
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3494 M407T2949 407.200012207031 407.200012207031 407.200012207031 2948.57935029677 2948.57935029677 2948.57935029677 1 1 0 [M-H]- 408.212 70 3.42635696563303 -1.04425555693909 0.486217387037195
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3495 M407T3789 407.200012207031 407.200012207031 407.200012207031 3788.51932376507 3788.51932376507 3788.51932376507 1 1 0 4455 2.79373736216104 -1.4530774568886 0.355781827769414
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3496 M407T3458 407.300018310547 407.300018310547 407.300018310547 3457.72866132448 3457.72866132448 3457.72866132448 1 0 1 1274 1.05128857104595 0.0353486741144851 0.975019617319876
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3497 M407T4037 407.300018310547 407.300018310547 407.300018310547 4037.35036373788 4037.35036373788 4037.35036373788 1 0 1 3769 2.50061782338147 0.743686472286336 0.55133661886358
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3498 M407T2999 407.300018310547 407.300018310547 407.300018310547 2998.82400467356 2998.82400467356 2998.82400467356 1 0 1 1822 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3499 M407T3135 407.300018310547 407.300018310547 407.300018310547 3134.57459104471 3134.57459104471 3134.57459104471 1 0 1 4997 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3500 M407T4143 407.300018310547 407.300018310547 407.300018310547 4142.54286529035 4142.54286529035 4142.54286529035 1 1 0 4227 6.38542168590663 -0.833237314150262 0.552422433431349
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3501 M407T2734 407.300018310547 407.300018310547 407.300018310547 2734.10499524488 2734.10499524488 2734.10499524488 1 1 0 2491 5.68158545990517 -0.8115188271184 0.559496239794861
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3502 M407T3507 407.399993896484 407.399993896484 407.399993896484 3507.32334791108 3507.32334791108 3507.32334791108 1 0 1 3377 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3503 M407T3752 407.399993896484 407.399993896484 407.399993896484 3751.82505250554 3751.82505250554 3751.82505250554 1 1 0 1053 7.00352542964288 -0.848607867330609 0.547486058420937
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3504 M407T3891 407.399993896484 407.399993896484 407.399993896484 3890.9572945896 3890.9572945896 3890.9572945896 1 1 0 2240 4.30767539780598 -0.747966455226424 0.581056270095856
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3505 M408T4009 407.5 407.5 407.5 4009.23164498528 4009.23164498528 4009.23164498528 1 1 0 5220 Inf -1 0.5
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lecorguille
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3506 M408T3340 407.600006103516 407.600006103516 407.600006103516 3339.90610931904 3339.90610931904 3339.90610931904 1 1 0 179 Inf -1 0.5
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lecorguille
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3507 M408T2528 407.899993896484 407.899993896484 407.899993896484 2527.882668269 2527.882668269 2527.882668269 1 0 1 5597 5.62503454012136 0.809530400138296 0.560150344250916
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3508 M408T2717 408 408 408 2717.09813305014 2717.09813305014 2717.09813305014 1 1 0 2447 1.74817776554525 -0.893805137473156 0.487806442663014
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lecorguille
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3509 M408T3866 408 408 408 3865.67503918027 3865.67503918027 3865.67503918027 1 1 0 1382 Inf -4.31605875214615 0.144942788716823
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lecorguille
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3510 M408T2898 408 408 408 2897.94212950607 2897.94212950607 2897.94212950607 1 1 0 4775 Inf -1 0.5
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lecorguille
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3511 M408T3164 408 408 408 3164.36061970144 3164.36061970144 3164.36061970144 1 0 1 819 1.17798908932367 0.201277321275161 0.866542448334469
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3512 M408T3373 408 408 408 3372.77706664296 3372.77706664296 3372.77706664296 1 1 0 25 Inf -2.67229047509869 0.227959919186247
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3513 M408T3318 408 408 408 3318.03592459747 3318.03592459747 3318.03592459747 1 0 1 567 1.26376358132372 0.163670583030352 0.885734117166313
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3514 M408T2601 408 408 408 2601.435668269 2601.435668269 2601.435668269 1 0 1 61 2.93200994490431 0.79718946824994 0.538446333270796
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3515 M408T3691 408 408 408 3690.87159551378 3690.87159551378 3690.87159551378 1 1 0 [M-H]- 409.007 5 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3516 M408T4024 408 408 408 4024.27788947618 4024.27788947618 4024.27788947618 1 1 0 5576 Inf -1 0.5
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lecorguille
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3517 M408T3923 408 408 408 3922.70694396493 3922.70694396493 3922.70694396493 1 0 1 2948 1.93752280798617 -0.455596891789627 0.71508345450681
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3518 M408T2926 408 408 408 2926.46996534627 2926.46996534627 2926.46996534627 1 0 1 2872 2.74080545610281 0.631486182662149 0.639476582907723
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3519 M408T3027 408 408 408 3027.2493518042 3027.2493518042 3027.2493518042 1 0 1 2146 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3520 M408T2892 408.100006103516 408.100006103516 408.100006103516 2892.2059563514 2891.82468804952 2892.58722465327 2 1 1 [64][M]- [M+Cl]- 373.129 [M-2H+Na]- 387.129 [M-H]- 409.106 95 4.33503084473214 -0.789803238789832 0.565926957275305
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3521 M408T3428 408.100006103516 408.100006103516 408.100006103516 3428.10491080308 3428.10491080308 3428.10491080308 1 0 1 5268 1.00799446829932 0.00563039194984769 0.996018771925957
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3522 M408T3550 408.100006103516 408.100006103516 408.100006103516 3550.11811785475 3550.11811785475 3550.11811785475 1 0 1 2342 2.44962592232674 1.41044432131789 0.375092795379397
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3523 M408T3651 408.100006103516 408.100006103516 408.100006103516 3651.37987508858 3651.37987508858 3651.37987508858 1 0 1 24 1.85012876880849 -1.72663209755335 0.329834867997282
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3524 M408T3421 408.200012207031 408.200012207031 408.200012207031 3421.06898084216 3421.06898084216 3421.06898084216 1 1 0 [M+Cl+HCOOH]- 327.214 11 1.36877826830539 -0.504016915327312 0.679493032583684
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3525 M408T3521 408.300018310547 408.300018310547 408.300018310547 3520.57714024828 3520.57714024828 3520.57714024828 1 0 1 369 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3526 M408T4108 408.300018310547 408.300018310547 408.300018310547 4108.07171749863 4108.07171749863 4108.07171749863 1 1 0 2279 2.34018879551028 -1.0010590837546 0.495735126255259
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3527 M408T2725 408.300018310547 408.300018310547 408.300018310547 2725.28754238135 2725.28754238135 2725.28754238135 1 0 1 2450 1.53824456713727 0.616895337194566 0.647662023577582
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3528 M408T3670 408.300018310547 408.300018310547 408.300018310547 3669.78466905985 3669.78466905985 3669.78466905985 1 1 0 [M-H-CH3]- 424.327 2 1.36869565719032 -0.217508099950445 0.849615992320172
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3529 M408T2825 408.300018310547 408.300018310547 408.300018310547 2824.6235093931 2824.6235093931 2824.6235093931 1 0 1 3318 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3530 M408T3956 408.300018310547 408.300018310547 408.300018310547 3955.84913291293 3955.84913291293 3955.84913291293 1 1 0 5459 1.07534387824552 -0.0791023223317626 0.946086678742966
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3531 M408T3743 408.300018310547 408.300018310547 408.300018310547 3743.26186830852 3743.26186830852 3743.26186830852 1 1 0 1019 2.59410341866898 0.748033118385988 0.552690916507205
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3532 M408T3711 408.300018310547 408.300018310547 408.300018310547 3710.74931945113 3710.74931945113 3710.74931945113 1 1 0 1154 1.06953087089149 0.0937155933122267 0.937271175405678
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3533 M408T3763 408.399993896484 408.399993896484 408.399993896484 3762.78203929079 3762.78203929079 3762.78203929079 1 0 1 935 1.14444044326166 -0.100212857678144 0.929327300009996
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3534 M408T3811 408.399993896484 408.399993896484 408.399993896484 3810.66063590017 3810.66063590017 3810.66063590017 1 1 0 2390 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3535 M408T4121 408.5 408.5 408.5 4120.69463726928 4120.69463726928 4120.69463726928 1 0 1 1727 Inf 1.6732976160136 0.342927572110054
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3536 M409T3900 408.600006103516 408.600006103516 408.600006103516 3899.75512111057 3899.75512111057 3899.75512111057 1 1 0 4787 7.33703339066876 -0.855792977449674 0.54519562854897
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3537 M409T3889 409 409 409 3889.37485310472 3889.37485310472 3889.37485310472 1 1 0 2241 Inf -5.67060406119648 0.11112412316474
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lecorguille
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3538 M409T3335 409 409 409 3335.47011079325 3335.47011079325 3335.47011079325 1 1 0 1111 Inf -1.13620715141171 0.459463227955641
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3539 M409T3402 409 409 409 3401.83439874172 3401.83439874172 3401.83439874172 1 1 0 20 2.55839421361764 -0.809540245354945 0.518289116538564
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3540 M409T3379 409 409 409 3378.68960817281 3378.68960817281 3378.68960817281 1 1 0 1570 3.36837324222385 -0.674043763365972 0.608271273819172
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lecorguille
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3541 M409T3550 409 409 409 3550.02927077143 3550.02927077143 3550.02927077143 1 1 0 2343 2.54000085575168 -0.564151917319112 0.654267403758462
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3542 M409T3481 409.100006103516 409.100006103516 409.100006103516 3481.05953206161 3481.05953206161 3481.05953206161 1 0 1 1766 1.24398642500684 -0.482031517769937 0.681998215849118
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3543 M409T3298 409.100006103516 409.100006103516 409.100006103516 3297.6219852069 3297.6219852069 3297.6219852069 1 1 0 2595 3.32092104150262 -0.797921831635186 0.559101603356276
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3544 M409T2891 409.100006103516 409.100006103516 409.100006103516 2891.00277522199 2891.00277522199 2891.00277522199 1 1 0 [64][M+1]- 95 3.14392487463783 -0.898326693516065 0.529610787275193
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lecorguille
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3545 M409T3244 409.100006103516 409.100006103516 409.100006103516 3243.86406452218 3243.86406452218 3243.86406452218 1 1 0 3466 8.0441726653623 -1.29737434711145 0.417463383426381
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3546 M409T2684 409.200012207031 409.200012207031 409.200012207031 2684.02899191347 2680.47603541585 2687.58194841108 2 2 0 6 1.64189159480549 -1.56028618904422 0.345784101726217
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3547 M409T2716 409.200012207031 409.200012207031 409.200012207031 2716.20347431755 2716.20347431755 2716.20347431755 1 1 0 2492 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3548 M409T2820 409.300018310547 409.300018310547 409.300018310547 2819.5807774389 2819.2492722149 2819.9122826629 2 1 1 3296 2.62685643564358 -0.578795817253634 0.647709445308799
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3549 M409T3732 409.300018310547 409.300018310547 409.300018310547 3732.37889703138 3732.37889703138 3732.37889703138 1 1 0 3565 4.87986044276266 -1.96736274157006 0.217149554660315
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lecorguille
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3550 M409T2916 409.300018310547 409.300018310547 409.300018310547 2915.94207310354 2915.94207310354 2915.94207310354 1 0 1 2769 Inf 1 0.5
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lecorguille
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3551 M409T3213 409.300018310547 409.300018310547 409.300018310547 3213.10641889902 3213.10641889902 3213.10641889902 1 0 1 4321 Inf 1 0.5
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lecorguille
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3552 M409T2666 409.300018310547 409.300018310547 409.300018310547 2666.35540765467 2666.35540765467 2666.35540765467 1 0 1 4047 Inf 1 0.5
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lecorguille
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3553 M409T3394 409.300018310547 409.300018310547 409.300018310547 3394.37824341737 3394.37824341737 3394.37824341737 1 1 0 487 6.68286611457024 -0.841000287356336 0.549922713624922
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lecorguille
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3554 M409T3040 409.300018310547 409.300018310547 409.300018310547 3039.70291287453 3039.70291287453 3039.70291287453 1 0 1 3222 Inf 1 0.5
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3555 M409T3740 409.399993896484 409.399993896484 409.399993896484 3740.14810708712 3740.14810708712 3740.14810708712 1 1 0 4714 2.41858942932208 -0.542031981718815 0.664437600154087
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lecorguille
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3556 M410T3758 409.800018310547 409.800018310547 409.800018310547 3758.17615966836 3758.17615966836 3758.17615966836 1 1 0 988 Inf -1 0.5
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lecorguille
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3557 M410T4124 410 410 410 4123.64097177674 4123.64097177674 4123.64097177674 1 1 0 1728 4.95347881252703 -0.782338823557086 0.569218501782389
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lecorguille
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3558 M410T3916 410.100006103516 410.100006103516 410.100006103516 3915.93434174525 3915.93434174525 3915.93434174525 1 0 1 5141 7.3576511409192 6.10100027496045 0.0789742377879732
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lecorguille
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3559 M410T2891 410.100006103516 410.100006103516 410.100006103516 2891.00277522199 2891.00277522199 2891.00277522199 1 1 0 [64][M+2]- 95 5.79235997089966 -0.876301446155209 0.541658691731422
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lecorguille
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3560 M410T3610 410.100006103516 410.100006103516 410.100006103516 3609.70367554127 3609.70367554127 3609.70367554127 1 0 1 2587 2.27290193466492 1.81006015301297 0.294550702243144
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lecorguille
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3561 M410T3579 410.100006103516 410.100006103516 410.100006103516 3578.62222459882 3578.62222459882 3578.62222459882 1 0 1 1671 5.36740947726424 0.799925595233211 0.563326517636846
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lecorguille
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3562 M410T4004 410.100006103516 410.100006103516 410.100006103516 4003.65561150242 4003.65561150242 4003.65561150242 1 1 0 5290 2.39700297293818 -0.745937556919248 0.545598201801257
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lecorguille
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3563 M410T3933 410.200012207031 410.200012207031 410.200012207031 3932.8546195664 3932.42727625425 3933.28196287856 2 1 1 2967 5.23826383427042 -1.99774825258407 0.230331911473634
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lecorguille
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3564 M410T3940 410.300018310547 410.300018310547 410.300018310547 3940.0809827203 3930.58943685684 3949.05152061741 4 2 2 4181 7.47410464144385 -6.99050137210034 0.0275960891888012
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lecorguille
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3565 M410T4174 410.300018310547 410.300018310547 410.300018310547 4174.16677245718 4169.77849887679 4178.55504603756 2 1 1 4393 1.03888972792182 0.0360466687228198 0.975916382218352
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lecorguille
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3566 M410T4193 410.300018310547 410.300018310547 410.300018310547 4193.4581189828 4193.4581189828 4193.4581189828 1 0 1 6163 Inf 1.65372413608316 0.346235292076706
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lecorguille
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3567 M410T3551 410.300018310547 410.300018310547 410.300018310547 3551.1449925006 3551.1449925006 3551.1449925006 1 0 1 2344 Inf 1 0.5
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lecorguille
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3568 M410T3219 410.300018310547 410.300018310547 410.300018310547 3219.0200668859 3219.0200668859 3219.0200668859 1 0 1 4292 1.79895458661337 -0.52007330979781 0.694357268125988
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lecorguille
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3569 M410T3651 410.300018310547 410.300018310547 410.300018310547 3651.18601684187 3651.18601684187 3651.18601684187 1 0 1 1539 Inf 2.94332730178986 0.208503021760804
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lecorguille
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3570 M410T2836 410.300018310547 410.300018310547 410.300018310547 2835.63126478354 2835.63126478354 2835.63126478354 1 0 1 4572 3.52390495770597 1.49528927114576 0.283868652484403
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lecorguille
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3571 M411T3064 410.899993896484 410.899993896484 410.899993896484 3063.70193515897 3063.70193515897 3063.70193515897 1 1 0 5411 Inf -1 0.5
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lecorguille
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3572 M411T4143 410.899993896484 410.899993896484 410.899993896484 4142.9532295589 4142.9532295589 4142.9532295589 1 0 1 4228 Inf 1 0.5
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lecorguille
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3573 M411T2589 410.899993896484 410.899993896484 410.899993896484 2589.06228676082 2589.06228676082 2589.06228676082 1 1 0 2894 Inf -1 0.5
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lecorguille
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3574 M411T4122 410.899993896484 410.899993896484 410.899993896484 4122.24572735991 4122.24572735991 4122.24572735991 1 0 1 1729 Inf 1 0.5
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lecorguille
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3575 M411T3484 411 411 411 3484.15058009239 3484.15058009239 3484.15058009239 1 0 1 1794 Inf 1 0.5
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lecorguille
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3576 M411T4059 411 411 411 4058.65996267593 4058.65996267593 4058.65996267593 1 0 1 4699 Inf 1 0.5
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lecorguille
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3577 M411T3819 411.200012207031 411.200012207031 411.200012207031 3819.03452474863 3819.03452474863 3819.03452474863 2 1 0 1860 2.87322780752629 -0.747366673356024 0.58433100751052
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lecorguille
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3578 M411T3935 411.200012207031 411.200012207031 411.200012207031 3935.35246496807 3935.35246496807 3935.35246496807 1 1 0 107 3.85767116037404 -6.28128856929454 0.0968780711181445
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lecorguille
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3579 M411T4179 411.200012207031 411.200012207031 411.200012207031 4178.55504603756 4178.55504603756 4178.55504603756 1 1 0 4394 1.03303116213902 0.0361708630181614 0.975974261594551
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lecorguille
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3580 M411T3667 411.200012207031 411.200012207031 411.200012207031 3666.83544083985 3666.83544083985 3666.83544083985 1 0 1 2 1.18607199611931 0.405603391387478 0.741359879885626
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lecorguille
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3581 M411T4146 411.300018310547 411.300018310547 411.300018310547 4145.51429793861 4145.51429793861 4145.51429793861 1 0 1 5832 48.9767519196799 3.86901527117542 0.158505261269787
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3582 M411T3831 411.300018310547 411.300018310547 411.300018310547 3831.06508336713 3831.06508336713 3831.06508336713 1 1 0 3341 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3583 M411T3158 411.300018310547 411.300018310547 411.300018310547 3158.12108870158 3158.12108870158 3158.12108870158 1 0 1 834 Inf 1 0.5
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lecorguille
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3584 M412T2683 411.899993896484 411.899993896484 411.899993896484 2682.82633158321 2682.82633158321 2682.82633158321 1 1 0 653 3.27285142098896 -0.664146271331794 0.612124299455897
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lecorguille
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3585 M412T2827 411.899993896484 411.899993896484 411.899993896484 2827.37320803523 2827.37320803523 2827.37320803523 1 1 0 121 6.34358142557307 -0.832085022203706 0.552794687259385
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lecorguille
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3586 M412T3480 412 412 412 3479.51387282006 3479.51387282006 3479.51387282006 1 0 1 31 3.5501284668741 0.691413940092917 0.60163546313647
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lecorguille
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3587 M412T2679 412 412 412 2679.22789039989 2679.22789039989 2679.22789039989 1 0 1 [M+Cl]- 377.03 6 12.9096767561311 5.81690725227811 0.047866088578721
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lecorguille
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3588 M412T4018 412 412 412 4018.23186265825 4018.23186265825 4018.23186265825 1 0 1 305 1.78620186301935 -0.745878784453949 0.572879350629321
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lecorguille
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3589 M412T4198 412 412 412 4198.19463586871 4198.19463586871 4198.19463586871 1 0 1 260 Inf 1 0.5
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lecorguille
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3590 M412T2600 412 412 412 2599.72397459635 2599.72397459635 2599.72397459635 1 1 0 61 8.69580924855494 -2.40803693987286 0.213652120334889
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lecorguille
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3591 M412T4141 412.100006103516 412.100006103516 412.100006103516 4140.86019981259 4140.86019981259 4140.86019981259 1 0 1 [M-H]- 413.107 4202 3.58472569037099 0.901676546317229 0.505324770129618
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lecorguille
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3592 M412T4155 412.100006103516 412.100006103516 412.100006103516 4155.07274902879 4155.07274902879 4155.07274902879 1 1 0 6210 Inf -1.16251570544976 0.452247007228788
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lecorguille
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3593 M412T4116 412.200012207031 412.200012207031 412.200012207031 4116.15002794601 4116.15002794601 4116.15002794601 1 0 1 120 1.41223463342746 -0.313333781933889 0.793825096754837
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lecorguille
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3594 M412T3462 412.200012207031 412.200012207031 412.200012207031 3462.3352029731 3462.3352029731 3462.3352029731 1 0 1 1259 10.9251433812731 0.955876112966944 0.513144957351162
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lecorguille
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3595 M412T4042 412.200012207031 412.200012207031 412.200012207031 4042.19385640378 4042.19385640378 4042.19385640378 1 1 0 5308 2.66366256887616 -1.95926456909717 0.297092195561308
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lecorguille
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3596 M412T4210 412.200012207031 412.200012207031 412.200012207031 4210.11191411352 4210.11191411352 4210.11191411352 1 1 0 4930 Inf -1 0.5
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lecorguille
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3597 M412T4111 412.300018310547 412.300018310547 412.300018310547 4111.20687455513 4101.96578596283 4111.39066323876 5 2 2 [65][M]- [M+Cl+HCOOH]- 331.312 43 8.33078162646729 -4.32286753963034 0.135621173678637
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3598 M412T2533 412.300018310547 412.300018310547 412.300018310547 2533.42708488001 2533.42708488001 2533.42708488001 1 0 1 5891 3.9400921658989 0.723267689085947 0.589861564012719
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3599 M412T3251 412.300018310547 412.300018310547 412.300018310547 3251.10362433335 3251.10362433335 3251.10362433335 1 0 1 1916 40.1171784999879 0.981589297451361 0.505750461632128
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3600 M412T3256 412.399993896484 412.399993896484 412.399993896484 3256.43182590051 3256.43182590051 3256.43182590051 1 1 0 1917 Inf -1 0.5
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3601 M412T2556 412.399993896484 412.399993896484 412.399993896484 2556.19728676082 2556.19728676082 2556.19728676082 1 1 0 3061 Inf -1 0.5
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3602 M412T3964 412.399993896484 412.399993896484 412.399993896484 3963.94513514887 3963.94513514887 3963.94513514887 1 1 0 2034 Inf -1 0.5
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3603 M412T4147 412.399993896484 412.399993896484 412.399993896484 4147.06511125254 4147.06511125254 4147.06511125254 1 0 1 189 1.07482338831984 -0.0509669935419382 0.964005548270197
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lecorguille
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3604 M412T3767 412.399993896484 412.399993896484 412.399993896484 3766.69939673832 3766.69939673832 3766.69939673832 1 1 0 989 Inf -1 0.5
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3605 M412T3408 412.399993896484 412.399993896484 412.399993896484 3408.40971363288 3408.40971363288 3408.40971363288 1 1 0 2560 Inf -1 0.5
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3606 M413T3845 412.899993896484 412.899993896484 412.899993896484 3845.19845958647 3845.19845958647 3845.19845958647 1 1 0 1383 Inf -1 0.5
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3607 M413T3269 413 413 413 3269.09240053867 3269.09240053867 3269.09240053867 1 1 0 5472 3.54872712524479 -0.691286804458732 0.601683461737374
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3608 M413T3728 413 413 413 3727.93766242873 3727.93766242873 3727.93766242873 1 0 1 3566 Inf 1 0.5
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3609 M413T2691 413 413 413 2691.44503823285 2691.44503823285 2691.44503823285 1 1 0 654 19.7128959712761 -6.01518119722744 0.0736880375172544
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3610 M413T2537 413 413 413 2537.271668269 2537.271668269 2537.271668269 1 0 1 5911 Inf 3.64315342032806 0.170543855849516
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3611 M413T2930 413 413 413 2929.89446868652 2929.89446868652 2929.89446868652 1 1 0 3615 7.06702353257905 -2.02065987984324 0.252077508561135
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3612 M413T4059 413 413 413 4059.4167690378 4059.4167690378 4059.4167690378 1 0 1 4700 Inf 1 0.5
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3613 M413T3766 413 413 413 3765.88055648032 3765.88055648032 3765.88055648032 1 0 1 990 Inf 1 0.5
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3614 M413T3629 413.100006103516 413.100006103516 413.100006103516 3629.35962620993 3624.36853107567 3634.30408221023 4 2 2 [66][M]- [M-2H+Na]- 392.112 26 1.69736913379485 -1.43345630074125 0.362471153404566
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3615 M413T4176 413.100006103516 413.100006103516 413.100006103516 4176.48836940693 4176.48836940693 4176.48836940693 1 0 1 4395 1.85512079706202 0.405755062678551 0.73427983350498
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3616 M413T3625 413.200012207031 413.200012207031 413.200012207031 3625.22401983803 3625.22401983803 3625.22401983803 1 0 1 1613 Inf 2.18728884960886 0.272991807846235
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3617 M413T4099 413.200012207031 413.200012207031 413.200012207031 4098.81380473002 4098.81380473002 4098.81380473002 1 0 1 150 1.1288440429424 0.116384252056692 0.92002160901508
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lecorguille
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3618 M413T4111 413.300018310547 413.300018310547 413.300018310547 4111.42132545829 4104.75744700432 4112.94133253275 5 2 2 [65][M+1]- 43 14.1362738315517 -4.98970764229639 0.125054630419577
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3619 M413T2564 413.300018310547 413.300018310547 413.300018310547 2564.02228676082 2564.02228676082 2564.02228676082 1 1 0 3075 Inf -1.54537015548846 0.365629666092151
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3620 M413T3058 413.300018310547 413.300018310547 413.300018310547 3058.10546667108 3058.10546667108 3058.10546667108 1 1 0 5775 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3621 M413T3185 413.300018310547 413.300018310547 413.300018310547 3184.64481211908 3184.64481211908 3184.64481211908 1 0 1 2196 3.69279013504146 1.69762799153042 0.318371091343191
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3622 M413T4082 413.399993896484 413.399993896484 413.399993896484 4081.69139793889 4078.8300086693 4084.55278720849 2 1 1 5724 1.65255226401238 0.337836686915369 0.773599473721319
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3623 M413T3936 413.399993896484 413.399993896484 413.399993896484 3936.43507866832 3936.43507866832 3936.43507866832 1 0 1 4153 3.64839143217605 1.96878540304461 0.189227075541495
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3624 M413T4135 413.399993896484 413.399993896484 413.399993896484 4134.65820643842 4134.65820643842 4134.65820643842 1 0 1 [M-H-CH3]- 429.431 99 Inf 1.18548753574492 0.446097740112672
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3625 M414T2842 413.899993896484 413.899993896484 413.899993896484 2842.48174449095 2842.48174449095 2842.48174449095 1 1 0 6052 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3626 M414T4132 414 414 414 4131.5173144866 4131.5173144866 4131.5173144866 1 1 0 1495 7.43887290330984 -0.857854530691264 0.544540288640759
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3627 M414T3989 414 414 414 3988.56493836266 3988.56493836266 3988.56493836266 1 0 1 4495 5.36669560979504 1.75169279537681 0.275772039645697
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3628 M414T3362 414 414 414 3361.97989608152 3361.97989608152 3361.97989608152 1 1 0 4658 Inf -1 0.5
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lecorguille
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3629 M414T3621 414.100006103516 414.100006103516 414.100006103516 3620.7862895733 3618.26031601074 3623.31226313586 2 2 0 [66][M+1]- 26 1.28145009577585 -0.449010551210318 0.724027016187975
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3630 M414T3862 414.100006103516 414.100006103516 414.100006103516 3861.50116492024 3861.50116492024 3861.50116492024 1 0 1 [M+Cl+NH3]- 362.106 [M+Cl]- 379.133 21 2.52942258248134 0.609134184160306 0.628106544270156
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3631 M414T3165 414.100006103516 414.100006103516 414.100006103516 3165.48828856966 3165.48828856966 3165.48828856966 1 0 1 818 1.65466187126443 0.545137941750848 0.649637850023135
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3632 M414T3055 414.200012207031 414.200012207031 414.200012207031 3054.95936385245 3053.908743692 3056.0099840129 2 1 1 [67][M]- 3481 2.18712217847203 0.898653754223295 0.533015924398388
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3633 M414T3637 414.200012207031 414.200012207031 414.200012207031 3636.92278687556 3631.97435968479 3641.87121406634 2 1 1 2845 1.2433614735454 -0.346169936448838 0.779188226380976
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3634 M414T3421 414.200012207031 414.200012207031 414.200012207031 3421.06898084216 3421.06898084216 3421.06898084216 1 1 0 11 6.09612384056384 -4.74411661740093 0.0892564394989841
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3635 M414T3470 414.200012207031 414.200012207031 414.200012207031 3470.24001135996 3470.24001135996 3470.24001135996 1 0 1 3106 16.0334385170878 1.06810371016356 0.478062477143063
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3636 M414T4108 414.300018310547 414.300018310547 414.300018310547 4107.90279661387 4107.90279661387 4107.90279661387 1 1 0 [65][M+2]- 43 23.3747575615229 -0.956756569966636 0.513820535705618
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3637 M414T3682 414.300018310547 414.300018310547 414.300018310547 3681.80953790472 3681.80953790472 3681.80953790472 1 1 0 597 6.09106825839138 -0.824783741542145 0.555161049227487
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3638 M414T4439 414.300018310547 414.300018310547 414.300018310547 4438.66422276304 4438.66422276304 4438.66422276304 1 1 0 6221 Inf -3.54708139323865 0.174936752972861
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3639 M414T3272 414.399993896484 414.399993896484 414.399993896484 3271.85845640343 3271.85845640343 3271.85845640343 1 0 1 5016 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3640 M414T3782 414.399993896484 414.399993896484 414.399993896484 3781.72876897582 3781.72876897582 3781.72876897582 1 0 1 88 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3641 M414T2981 414.399993896484 414.399993896484 414.399993896484 2981.38883057329 2981.38883057329 2981.38883057329 1 1 0 4626 11.1164589997685 -0.906383364832457 0.529291806209435
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3642 M414T4130 414.399993896484 414.399993896484 414.399993896484 4130.33844192957 4130.33844192957 4130.33844192957 1 0 1 1466 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3643 M415T3884 414.899993896484 414.899993896484 414.899993896484 3884.15468055726 3884.15468055726 3884.15468055726 1 1 0 2242 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3644 M415T3108 415 415 415 3108.41931923499 3108.41931923499 3108.41931923499 1 1 0 3138 Inf -2.9322297283664 0.209236620522277
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3645 M415T3482 415 415 415 3482.36454836522 3482.36454836522 3482.36454836522 1 1 0 1795 18.5121105703983 -1.05548386587044 0.48181613897555
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3646 M415T2822 415.100006103516 415.100006103516 415.100006103516 2822.34220338741 2822.34220338741 2822.34220338741 1 1 0 3297 1.66841893921386 -0.812250542246428 0.520379482277679
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3647 M415T3657 415.200012207031 415.200012207031 415.200012207031 3656.55574542826 3656.55574542826 3656.55574542826 1 1 0 2405 1.99323904314022 -1.36733780028117 0.387301019896806
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3648 M415T2909 415.200012207031 415.200012207031 415.200012207031 2909.41319283123 2909.41319283123 2909.41319283123 1 0 1 2770 Inf 4.4644222572392 0.140282923348306
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3649 M415T3054 415.200012207031 415.200012207031 415.200012207031 3053.908743692 3053.908743692 3053.908743692 1 0 1 [67][M+1]- 3477 3.44566360544287 1.30285699319512 0.416411259039114
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3650 M415T3626 415.200012207031 415.200012207031 415.200012207031 3625.889727528 3625.889727528 3625.889727528 1 1 0 26 1.72865326874699 -2.03172067222787 0.248744701502434
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3651 M415T2758 415.200012207031 415.200012207031 415.200012207031 2758.4436988779 2758.4436988779 2758.4436988779 1 1 0 5492 Inf -1.48843264573824 0.376612083825177
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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3652 M415T3345 415.300018310547 415.300018310547 415.300018310547 3345.05031410584 3345.05031410584 3345.05031410584 1 0 1 810 Inf 1.27343573596916 0.423797086988895
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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3653 M415T3750 415.300018310547 415.300018310547 415.300018310547 3750.2397670483 3750.2397670483 3750.2397670483 1 1 0 1054 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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3654 M415T3900 415.399993896484 415.399993896484 415.399993896484 3900.16511314389 3900.16511314389 3900.16511314389 1 0 1 4836 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3655 M415T3975 415.399993896484 415.399993896484 415.399993896484 3974.68916595072 3974.68916595072 3974.68916595072 1 1 0 2035 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3656 M416T3127 415.899993896484 415.899993896484 415.899993896484 3127.40464345301 3127.40464345301 3127.40464345301 1 1 0 5591 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3657 M416T3036 415.899993896484 415.899993896484 415.899993896484 3035.99583720966 3035.99583720966 3035.99583720966 1 1 0 3223 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3658 M416T3848 416 416 416 3848.34429314272 3848.34429314272 3848.34429314272 1 1 0 1384 Inf -6.18450203401107 0.102054627032067
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3659 M416T3134 416 416 416 3133.69466422371 3133.69466422371 3133.69466422371 1 0 1 4998 2.76257444763261 0.59992414743997 0.638488352544177
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3660 M416T2598 416 416 416 2598.305668269 2598.305668269 2598.305668269 1 0 1 2895 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3661 M416T3598 416 416 416 3598.21706108862 3598.21706108862 3598.21706108862 1 0 1 1454 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3662 M416T2686 416.100006103516 416.100006103516 416.100006103516 2685.59835514261 2682.4546014594 2687.58718990559 4 2 2 [M+Cl+HCOOH]- 335.127 6 1.07546233088135 -0.663577746515818 0.609190754276434
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3663 M416T3342 416.100006103516 416.100006103516 416.100006103516 3341.65881977194 3341.65881977194 3341.65881977194 1 0 1 9 3.0128315500829 0.883270130456007 0.539260635089669
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3664 M416T3628 416.300018310547 416.300018310547 416.300018310547 3628.24021027642 3628.24021027642 3628.24021027642 1 0 1 1614 5.7588383268828 2.46549170965455 0.158787284253347
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3665 M416T3542 416.300018310547 416.300018310547 416.300018310547 3542.48800928712 3542.48800928712 3542.48800928712 1 1 0 2324 24.3644717222282 -0.958149941089772 0.513174735450313
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3666 M416T3750 416.300018310547 416.300018310547 416.300018310547 3750.2397670483 3750.2397670483 3750.2397670483 1 1 0 1055 3.08201543409466 -0.780057735521857 0.574747237481707
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3667 M416T3992 416.399993896484 416.399993896484 416.399993896484 3991.96096682722 3991.96096682722 3991.96096682722 1 1 0 4496 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3668 M416T3840 416.399993896484 416.399993896484 416.399993896484 3839.92184472867 3839.92184472867 3839.92184472867 1 1 0 3166 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3669 M416T3318 416.399993896484 416.399993896484 416.399993896484 3318.46243229815 3318.46243229815 3318.46243229815 1 0 1 538 3.85911795620692 0.740354773684412 0.594001862243017
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3670 M417T2951 416.600006103516 416.600006103516 416.600006103516 2951.39802213927 2951.39802213927 2951.39802213927 1 0 1 3188 13.474949848695 0.92324936552831 0.524040941466761
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3671 M417T2959 416.800018310547 416.800018310547 416.800018310547 2959.39764053649 2956.38112052823 2962.41416054475 2 1 1 3258 4.27659574468099 -0.746044879176904 0.581731863169952
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3672 M417T2806 416.800018310547 416.800018310547 416.800018310547 2806.08281491234 2806.08281491234 2806.08281491234 1 0 1 5185 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3673 M417T3445 416.899993896484 416.899993896484 416.899993896484 3444.9796756261 3444.9796756261 3444.9796756261 1 1 0 62 87.5132721245517 -0.988508627830879 0.503644676629031
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3674 M417T2646 416.899993896484 416.899993896484 416.899993896484 2646.06874587309 2646.06874587309 2646.06874587309 1 1 0 5941 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3675 M417T3288 417 417 417 3288.11771889047 3288.11771889047 3288.11771889047 1 0 1 2112 1.74631886593251 -0.757210600330104 0.530913921471826
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3676 M417T4136 417 417 417 4136.27730756024 4136.27730756024 4136.27730756024 1 1 0 3979 9.08724454003677 -0.889505356743444 0.536944149432538
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3677 M417T3417 417 417 417 3416.66862409634 3416.66862409634 3416.66862409634 1 0 1 11 2.76890728433465 -0.761127126008477 0.560265928997258
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lecorguille
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3678 M417T3380 417.100006103516 417.100006103516 417.100006103516 3380.47786867874 3380.47786867874 3380.47786867874 1 1 0 [M+Cl]- 382.134 25 3.37585076611308 -0.831810155766232 0.532558933935769
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lecorguille
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3679 M417T3718 417.100006103516 417.100006103516 417.100006103516 3718.49152830969 3718.49152830969 3718.49152830969 1 0 1 3445 1.71628131074187 0.405064456045409 0.749036383654831
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3680 M417T4172 417.200012207031 417.200012207031 417.200012207031 4172.29378219593 4172.29378219593 4172.29378219593 1 1 0 4396 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3681 M417T2794 417.200012207031 417.200012207031 417.200012207031 2794.48110315048 2794.48110315048 2794.48110315048 1 1 0 914 14.4715126684131 -0.928684136811831 0.522350540226586
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3682 M417T3231 417.200012207031 417.200012207031 417.200012207031 3231.48982766231 3231.48982766231 3231.48982766231 1 1 0 2694 1.06185281036797 0.108506200564487 0.930918770538544
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
3683 M417T3274 417.300018310547 417.300018310547 417.300018310547 3273.93376916172 3273.93376916172 3273.93376916172 1 0 1 5017 1.38043355504639 0.282689833261004 0.804241287981855
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3684 M417T3050 417.300018310547 417.300018310547 417.300018310547 3049.85437775332 3049.85437775332 3049.85437775332 1 1 0 3491 3.87470383440671 -0.718376776467711 0.591637678730474
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
3685 M417T4066 417.300018310547 417.300018310547 417.300018310547 4066.41996987292 4066.41996987292 4066.41996987292 1 0 1 3891 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3686 M417T3758 417.300018310547 417.300018310547 417.300018310547 3758.17615966836 3758.17615966836 3758.17615966836 1 1 0 991 Inf -1.24786636625454 0.430084050729691
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
3687 M417T3816 417.300018310547 417.300018310547 417.300018310547 3815.82003697799 3815.82003697799 3815.82003697799 1 1 0 2373 1.29529295787488 -0.18045350892655 0.874361869047089
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
3688 M417T3216 417.300018310547 417.300018310547 417.300018310547 3215.8909481287 3215.8909481287 3215.8909481287 1 0 1 4322 4.45924329962739 0.756946908924959 0.577919065632648
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
3689 M417T3963 417.399993896484 417.399993896484 417.399993896484 3963.47612053684 3963.47612053684 3963.47612053684 1 0 1 [M+Cl]- 382.433 [M-H]- 418.409 36 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3690 M417T3766 417.399993896484 417.399993896484 417.399993896484 3766.13569303222 3766.13569303222 3766.13569303222 1 1 0 992 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3691 M418T4011 417.700012207031 417.700012207031 417.700012207031 4010.80158041945 4010.80158041945 4010.80158041945 1 1 0 5221 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3692 M418T2634 417.899993896484 417.899993896484 417.899993896484 2634.41938078827 2634.41938078827 2634.41938078827 1 1 0 2650 4.67629795496873 -0.768774315929361 0.573836259331371
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3693 M418T3109 418 418 418 3109.26675111961 3109.26675111961 3109.26675111961 1 0 1 5346 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3694 M418T3748 418 418 418 3747.93808446807 3747.93808446807 3747.93808446807 1 1 0 1056 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3695 M418T4194 418 418 418 4194.40921882124 4194.40921882124 4194.40921882124 1 1 0 6164 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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3696 M418T4118 418.100006103516 418.100006103516 418.100006103516 4117.59270567894 4117.59270567894 4117.59270567894 1 0 1 4559 Inf 5.69923019827122 0.110577154025813
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3697 M418T4142 418.100006103516 418.100006103516 418.100006103516 4142.41184997807 4142.41184997807 4142.41184997807 1 0 1 4229 1.9175736000496 0.424280542398023 0.724061059322739
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3698 M418T4136 418.300018310547 418.300018310547 418.300018310547 4136.2093331095 4136.2093331095 4136.2093331095 1 0 1 3980 2.03150936690868 2.77731416620396 0.11133991390371
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3699 M418T4276 418.300018310547 418.300018310547 418.300018310547 4276.01974443202 4276.01974443202 4276.01974443202 1 0 1 318 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3700 M418T3624 418.300018310547 418.300018310547 418.300018310547 3624.36853107567 3624.36853107567 3624.36853107567 1 1 0 1615 1.47287449039905 -0.265619619625094 0.818349595491394
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3701 M418T4087 418.300018310547 418.300018310547 418.300018310547 4086.58270444214 4086.58270444214 4086.58270444214 1 0 1 4981 1.21590027993977 0.346559067583395 0.787615095356994
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3702 M418T3317 418.399993896484 418.399993896484 418.399993896484 3316.91873178114 3316.91873178114 3316.91873178114 1 0 1 539 Inf 2.11173744632906 0.281551123052158
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3703 M418T4187 418.399993896484 418.399993896484 418.399993896484 4186.55782122692 4186.55782122692 4186.55782122692 1 1 0 6063 3.46940584436228 -0.683923229328104 0.604477707115954
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3704 M419T4218 419 419 419 4218.24060818352 4218.24060818352 4218.24060818352 1 0 1 5321 1.71840912174008 0.49179342893974 0.671711767301434
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
3705 M419T4198 419 419 419 4198.19463586871 4198.19463586871 4198.19463586871 1 0 1 6083 2.07363397213689 0.770236011473756 0.521760017220124
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
3706 M419T4125 419.100006103516 419.100006103516 419.100006103516 4125.41137458382 4124.0320044962 4126.79074467143 2 1 1 [M+Cl+CF3COOH]- 250.133 [M-H+CF3COOH]- 286.109 23 1.48065371584356 0.317839275890341 0.788909595115335
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
3707 M419T3890 419.100006103516 419.100006103516 419.100006103516 3889.77519285019 3889.77519285019 3889.77519285019 1 0 1 41 1.59057301303759 0.384753829684853 0.738225385886932
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
3708 M419T3728 419.100006103516 419.100006103516 419.100006103516 3727.7273314968 3727.7273314968 3727.7273314968 1 1 0 3567 29.9765118105808 -1.1136293204433 0.465382270419696
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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3709 M419T3211 419.100006103516 419.100006103516 419.100006103516 3211.49389160157 3211.49389160157 3211.49389160157 1 1 0 [M-H-H20]- 438.111 4280 1.57723608372481 -0.400166693834885 0.730400316952821
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3710 M419T3188 419.200012207031 419.200012207031 419.200012207031 3187.97882224249 3187.97882224249 3187.97882224249 1 1 0 2175 1.60935603641252 0.557107982852732 0.662355877048711
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
3711 M419T3387 419.200012207031 419.200012207031 419.200012207031 3386.6458896204 3386.6458896204 3386.6458896204 1 1 0 488 1.12254858368401 -0.102102692980258 0.932290649427813
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
3712 M419T3782 419.200012207031 419.200012207031 419.200012207031 3781.72876897582 3781.72876897582 3781.72876897582 1 0 1 88 1.71562066044671 0.624326439290462 0.624628148506025
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
3713 M419T4122 419.200012207031 419.200012207031 419.200012207031 4122.24572735991 4122.24572735991 4122.24572735991 1 0 1 1740 1.63826758895443 0.386494502662244 0.763623576152738
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
3714 M419T3977 419.300018310547 419.300018310547 419.300018310547 3976.6553407534 3976.6553407534 3976.6553407534 1 1 0 2036 5.18337252151149 -0.792462459340471 0.565814342147601
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
3715 M419T3523 419.300018310547 419.300018310547 419.300018310547 3522.90390220282 3522.90390220282 3522.90390220282 1 0 1 404 5.35647497240828 1.85817951360916 0.252663635594623
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
3716 M419T3671 419.300018310547 419.300018310547 419.300018310547 3671.30254208865 3671.30254208865 3671.30254208865 1 1 0 437 1.12663006771514 -0.0840603766031529 0.940760383171338
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3717 M419T2853 419.399993896484 419.399993896484 419.399993896484 2852.93614997265 2852.93614997265 2852.93614997265 1 0 1 4260 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3718 M420T2872 419.899993896484 419.899993896484 419.899993896484 2872.09955249099 2872.09955249099 2872.09955249099 1 1 0 4759 Inf -1.16322785268034 0.452054271331495
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
3719 M420T2931 419.899993896484 419.899993896484 419.899993896484 2931.11055668219 2931.11055668219 2931.11055668219 1 0 1 3627 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
3720 M420T2587 419.899993896484 419.899993896484 419.899993896484 2586.63608488001 2586.63608488001 2586.63608488001 1 0 1 2896 4.37565999888765 0.897457039007433 0.517917217982135
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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3721 M420T4020 419.899993896484 419.899993896484 419.899993896484 4019.78995198096 4019.78995198096 4019.78995198096 1 0 1 5577 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3722 M420T4131 420 420 420 4130.9307538347 4125.21574106915 4136.64576660025 2 1 1 23 2.36148325520357 -0.56308962170568 0.666716694157478
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
3723 M420T3155 420 420 420 3154.99597263236 3154.99597263236 3154.99597263236 1 0 1 229 4.34072092338114 -0.749978868857412 0.580350388017952
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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3724 M420T3878 420.200012207031 420.200012207031 420.200012207031 3877.89379459742 3877.89379459742 3877.89379459742 1 1 0 55 2.78757670412397 -0.809828248530525 0.554314133194921
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3725 M420T3849 420.200012207031 420.200012207031 420.200012207031 3849.49584920062 3849.49584920062 3849.49584920062 1 1 0 [M+Cl+NH3]- 368.206 21 3.31243685843259 -0.934219199222996 0.506838919829221
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3726 M420T4118 420.200012207031 420.200012207031 420.200012207031 4117.72633782937 4117.72633782937 4117.72633782937 1 0 1 120 13.8204426329907 1.02906431948112 0.489139515151486
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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3727 M420T3100 420.300018310547 420.300018310547 420.300018310547 3099.75267122727 3099.75267122727 3099.75267122727 1 0 1 3139 7.02350239178952 0.84905809860365 0.54734223444492
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3728 M420T3908 420.300018310547 420.300018310547 420.300018310547 3907.5377840068 3907.5377840068 3907.5377840068 1 1 0 4793 1.16294160100629 -0.106236396762771 0.925282757650011
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3729 M420T2710 420.300018310547 420.300018310547 420.300018310547 2709.68381781752 2709.68381781752 2709.68381781752 1 0 1 5878 3.95718312823709 0.724519147175832 0.589408878845084
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3730 M420T2740 420.300018310547 420.300018310547 420.300018310547 2739.56197376761 2739.56197376761 2739.56197376761 1 1 0 4434 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3731 M420T4204 420.300018310547 420.300018310547 420.300018310547 4203.83094854974 4203.83094854974 4203.83094854974 1 1 0 5695 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3732 M420T4142 420.300018310547 420.300018310547 420.300018310547 4142.41184997807 4142.41184997807 4142.41184997807 1 0 1 4230 1.42271756775629 0.581656473112037 0.636920895639959
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3733 M420T3545 420.399993896484 420.399993896484 420.399993896484 3545.42684473664 3545.42684473664 3545.42684473664 1 0 1 2345 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3734 M420T4187 420.399993896484 420.399993896484 420.399993896484 4186.55782122692 4186.55782122692 4186.55782122692 1 1 0 6064 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3735 M421T2688 420.899993896484 420.899993896484 420.899993896484 2688.32459589356 2688.32459589356 2688.32459589356 1 1 0 655 Inf -2.78419130945602 0.21952002666332
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3736 M421T3691 420.899993896484 420.899993896484 420.899993896484 3690.87159551378 3690.87159551378 3690.87159551378 1 1 0 5 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3737 M421T3073 421 421 421 3072.81561729488 3072.81561729488 3072.81561729488 1 0 1 2432 Inf 1 0.5
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lecorguille
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3738 M421T2785 421 421 421 2785.35626528247 2785.35626528247 2785.35626528247 1 0 1 895 3.67923345944019 0.963511665308532 0.510345908263362
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3739 M421T3096 421.200012207031 421.200012207031 421.200012207031 3095.9153929194 3095.9153929194 3095.9153929194 1 1 0 5379 5.68628184959386 -2.78777985215764 0.189587592202137
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3740 M421T4214 421.200012207031 421.200012207031 421.200012207031 4213.60166691331 4213.60166691331 4213.60166691331 1 0 1 5324 Inf 1 0.5
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lecorguille
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3741 M421T3112 421.300018310547 421.300018310547 421.300018310547 3112.43657530524 3112.43657530524 3112.43657530524 1 0 1 5347 Inf 1 0.5
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lecorguille
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3742 M421T3868 421.300018310547 421.300018310547 421.300018310547 3868.47300027811 3868.47300027811 3868.47300027811 1 1 0 21 4.17237440205554 -0.758575663736998 0.585910200045251
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lecorguille
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3743 M421T3516 421.300018310547 421.300018310547 421.300018310547 3515.66717457865 3515.66717457865 3515.66717457865 1 1 0 351 1.64743412130824 -1.71278152736338 0.280494472699865
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lecorguille
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3744 M421T2714 421.300018310547 421.300018310547 421.300018310547 2713.53380950427 2713.53380950427 2713.53380950427 1 0 1 2493 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3745 M421T3054 421.300018310547 421.300018310547 421.300018310547 3053.68274380949 3053.68274380949 3053.68274380949 1 0 1 3492 Inf 1 0.5
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lecorguille
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3746 M421T4050 421.300018310547 421.300018310547 421.300018310547 4049.61097536975 4049.61097536975 4049.61097536975 1 1 0 3427 2.23086036254205 -0.611580552598098 0.636258648389813
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lecorguille
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3747 M421T3379 421.300018310547 421.300018310547 421.300018310547 3378.68960817281 3378.68960817281 3378.68960817281 1 1 0 1571 Inf -1 0.5
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lecorguille
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3748 M421T4182 421.300018310547 421.300018310547 421.300018310547 4181.68550617079 4181.68550617079 4181.68550617079 1 1 0 6007 Inf -5.66067677369441 0.111315060054647
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lecorguille
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3749 M422T2863 421.5 421.5 421.5 2862.7538672413 2862.7538672413 2862.7538672413 1 0 1 3648 Inf 1 0.5
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lecorguille
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3750 M422T3517 421.800018310547 421.800018310547 421.800018310547 3516.65642566571 3516.65642566571 3516.65642566571 1 0 1 405 1.89569817168539 -0.577913247390159 0.623149072029786
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lecorguille
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3751 M422T3165 421.899993896484 421.899993896484 421.899993896484 3165.48828856966 3165.48828856966 3165.48828856966 1 0 1 835 Inf 1 0.5
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lecorguille
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3752 M422T3549 422 422 422 3548.55320075327 3548.55320075327 3548.55320075327 1 0 1 2346 3.22537355085637 0.659011058158968 0.614144563941174
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lecorguille
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3753 M422T4118 422 422 422 4117.59270567894 4117.59270567894 4117.59270567894 1 0 1 4560 1.80132248574022 0.801062247899821 0.569893706293914
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lecorguille
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3754 M422T3620 422 422 422 3620.19051163634 3620.19051163634 3620.19051163634 1 1 0 51 Inf -1 0.5
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lecorguille
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3755 M422T2892 422.100006103516 422.100006103516 422.100006103516 2892.22108804407 2891.00277522199 2893.43940086615 2 1 1 [68][M]- [M+Cl]- 387.129 [M-H]- 423.106 95 3.86673063402012 -0.82434595339381 0.554977790989583
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lecorguille
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3756 M422T3741 422.100006103516 422.100006103516 422.100006103516 3740.75180972326 3740.75180972326 3740.75180972326 1 1 0 1057 3.1298940383809 -0.983301271936639 0.499237960100976
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lecorguille
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3757 M422T3275 422.100006103516 422.100006103516 422.100006103516 3275.12473374223 3275.12473374223 3275.12473374223 1 1 0 5018 1.54741700321375 -0.640689118058943 0.627141440955996
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lecorguille
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3758 M422T3755 422.200012207031 422.200012207031 422.200012207031 3754.99866028928 3754.99866028928 3754.99866028928 1 1 0 [M-2H+Na]- 401.212 [M-H]- 423.212 14 2.92513702192382 -0.772884837586998 0.580273299141746
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lecorguille
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3759 M422T3624 422.300018310547 422.300018310547 422.300018310547 3623.88735388893 3619.79272593751 3627.98198184035 2 2 0 26 3.73564341849642 -1.58061536176709 0.267941084986234
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lecorguille
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3760 M422T3666 422.300018310547 422.300018310547 422.300018310547 3665.85204372625 3665.85204372625 3665.85204372625 1 1 0 447 3.70633674412125 -0.70498242994391 0.596559722380385
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lecorguille
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3761 M422T3796 422.300018310547 422.300018310547 422.300018310547 3795.99336089506 3795.99336089506 3795.99336089506 1 0 1 123 2.75426223284291 1.36805973763889 0.309990949998368
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lecorguille
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3762 M422T2918 422.300018310547 422.300018310547 422.300018310547 2918.39175940831 2918.39175940831 2918.39175940831 1 1 0 2771 1.17863976275424 -0.150011131027436 0.904453665835992
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3763 M422T3308 422.399993896484 422.399993896484 422.399993896484 3308.41925454435 3308.41925454435 3308.41925454435 1 1 0 540 4.44299667230136 -0.756014159448025 0.5782433864059
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3764 M422T3883 422.399993896484 422.399993896484 422.399993896484 3883.49697372308 3883.49697372308 3883.49697372308 1 0 1 2243 Inf 1 0.5
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lecorguille
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3765 M422T4078 422.399993896484 422.399993896484 422.399993896484 4078.279061465 4078.279061465 4078.279061465 1 1 0 3892 2.27631166984726 -0.539986250699574 0.674727355389491
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3766 M423T3754 422.700012207031 422.700012207031 422.700012207031 3754.18258464012 3754.18258464012 3754.18258464012 1 1 0 1058 Inf -1 0.5
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lecorguille
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3767 M423T4143 422.899993896484 422.899993896484 422.899993896484 4142.54464326502 4142.54464326502 4142.54464326502 1 1 0 4231 2.12157819380275 -0.478194991025209 0.695609989302795
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3768 M423T3741 423 423 423 3740.75180972326 3740.75180972326 3740.75180972326 1 1 0 1059 7.2528027215669 -0.854042693713874 0.545752646484387
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3769 M423T3810 423 423 423 3810.24521108022 3810.24521108022 3810.24521108022 1 0 1 2391 Inf 1 0.5
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lecorguille
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3770 M423T3571 423 423 423 3570.5915589332 3570.5915589332 3570.5915589332 1 0 1 1672 Inf 1 0.5
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lecorguille
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3771 M423T3247 423.100006103516 423.100006103516 423.100006103516 3247.42680631808 3244.73362669097 3250.11998594519 2 2 0 1918 17.0553587147764 -4.2281357942568 0.143651427081135
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3772 M423T2893 423.100006103516 423.100006103516 423.100006103516 2892.58722465327 2892.58722465327 2892.58722465327 1 1 0 [68][M+1]- 95 2.89268417639449 -0.847920399810531 0.55154685930821
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3773 M423T3883 423.200012207031 423.200012207031 423.200012207031 3882.59075902174 3882.59075902174 3882.59075902174 2 1 0 41 7.18885115761043 -1.00923103300084 0.493020510695678
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lecorguille
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3774 M423T3238 423.200012207031 423.200012207031 423.200012207031 3237.65577375214 3237.65577375214 3237.65577375214 1 1 0 2716 8.52431421807777 -0.882669583840798 0.539613544031333
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3775 M423T2903 423.200012207031 423.200012207031 423.200012207031 2903.11197086023 2903.11197086023 2903.11197086023 1 0 1 3917 Inf 62.3812022181189 0.0102044402182746
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3776 M423T3697 423.300018310547 423.300018310547 423.300018310547 3696.96574178763 3696.96574178763 3696.96574178763 1 1 0 5484 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3777 M423T3316 423.300018310547 423.300018310547 423.300018310547 3316.30541332026 3316.30541332026 3316.30541332026 1 1 0 4 22.9813081413664 -1.61368291902509 0.35124744482148
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3778 M423T3809 423.300018310547 423.300018310547 423.300018310547 3809.08960940144 3809.08960940144 3809.08960940144 1 1 0 3712 7.30192078131113 -0.855068417708653 0.545426145005124
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3779 M423T3008 423.300018310547 423.300018310547 423.300018310547 3008.32365642662 3008.32365642662 3008.32365642662 1 0 1 2083 Inf 1 0.5
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lecorguille
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3780 M423T4133 423.399993896484 423.399993896484 423.399993896484 4133.10622634158 4133.10622634158 4133.10622634158 1 0 1 1496 8.75937456651398 0.880119740498438 0.537507657057071
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3781 M424T3970 423.5 423.5 423.5 3969.55274519577 3969.55274519577 3969.55274519577 1 0 1 2037 Inf 1 0.5
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lecorguille
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3782 M424T3528 423.899993896484 423.899993896484 423.899993896484 3527.62878275516 3527.62878275516 3527.62878275516 1 1 0 406 Inf -1 0.5
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lecorguille
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3783 M424T3038 423.899993896484 423.899993896484 423.899993896484 3038.23244317119 3038.23244317119 3038.23244317119 1 0 1 71 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3784 M424T3857 424 424 424 3856.78184598162 3856.78184598162 3856.78184598162 1 0 1 1385 Inf 1.37193539989563 0.400980069155201
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3785 M424T3421 424 424 424 3421.06898084216 3421.06898084216 3421.06898084216 1 1 0 855 Inf -1 0.5
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lecorguille
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3786 M424T3236 424 424 424 3236.24872401132 3236.24872401132 3236.24872401132 1 0 1 54 1.19194288050994 -0.123367006424101 0.913396954182273
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3787 M424T3513 424.100006103516 424.100006103516 424.100006103516 3513.42292224559 3513.42292224559 3513.42292224559 1 1 0 119 8.28591267973197 -2.45368798137779 0.204035327334327
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lecorguille
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3788 M424T3536 424.100006103516 424.100006103516 424.100006103516 3536.07605941712 3536.07605941712 3536.07605941712 1 0 1 1936 86.4345103738347 1.00955359408632 0.496936208955772
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lecorguille
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3789 M424T4124 424.100006103516 424.100006103516 424.100006103516 4123.64097177674 4123.64097177674 4123.64097177674 1 1 0 1730 3.38905030289082 -2.1165061203685 0.208303685233943
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3790 M424T3439 424.100006103516 424.100006103516 424.100006103516 3438.62309535411 3438.62309535411 3438.62309535411 1 1 0 4883 Inf -1.81150388620152 0.321110068615192
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lecorguille
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3791 M424T2950 424.200012207031 424.200012207031 424.200012207031 2950.139046458 2949.29640186015 2951.33707180613 3 2 1 [69][M]- 70 6.59450035671148 -0.993654369251393 0.500730873832471
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lecorguille
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3792 M424T3147 424.200012207031 424.200012207031 424.200012207031 3147.22673309898 3145.72227167146 3148.73119452649 2 1 1 64 1.40962201753454 -0.398715208846085 0.728681418579641
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lecorguille
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3793 M424T3994 424.200012207031 424.200012207031 424.200012207031 3993.68137412422 3992.54085125997 3994.82189698848 2 1 1 118 3.70232339766907 -1.45691373032367 0.323536666696155
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lecorguille
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3794 M424T3881 424.200012207031 424.200012207031 424.200012207031 3881.02599652615 3881.02599652615 3881.02599652615 1 1 0 132 6.41595178165766 -1.92227125637596 0.304084532625136
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lecorguille
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3795 M424T3550 424.200012207031 424.200012207031 424.200012207031 3550.11811785475 3550.11811785475 3550.11811785475 1 0 1 2320 2.47982175440853 0.599901541378774 0.639356438360859
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lecorguille
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3796 M424T4108 424.300018310547 424.300018310547 424.300018310547 4108.26902823653 4108.26902823653 4108.26902823653 1 0 1 43 1.14170528400573 0.120331978007822 0.922026780870588
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3797 M424T2732 424.300018310547 424.300018310547 424.300018310547 2731.73213489679 2731.73213489679 2731.73213489679 1 1 0 2494 4.27943264662664 -0.746221455116638 0.581669717614867
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lecorguille
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3798 M424T3353 424.300018310547 424.300018310547 424.300018310547 3353.0327267314 3353.0327267314 3353.0327267314 1 0 1 732 1.15369443027986 0.130128754057786 0.916175016600284
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lecorguille
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3799 M424T4009 424.300018310547 424.300018310547 424.300018310547 4009.23164498528 4009.23164498528 4009.23164498528 1 1 0 5222 5.31378363974974 -0.968167413523953 0.497617047656064
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lecorguille
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3800 M424T2930 424.300018310547 424.300018310547 424.300018310547 2929.96472679346 2929.96472679346 2929.96472679346 1 0 1 3628 Inf 1 0.5
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lecorguille
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3801 M424T3310 424.399993896484 424.399993896484 424.399993896484 3310.1554922049 3310.1554922049 3310.1554922049 1 0 1 541 Inf 1 0.5
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lecorguille
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3802 M424T3461 424.5 424.5 424.5 3460.80362206259 3460.80362206259 3460.80362206259 1 0 1 1275 Inf 1 0.5
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lecorguille
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diff changeset
3803 M425T4058 424.600006103516 424.600006103516 424.600006103516 4057.8849144412 4057.8849144412 4057.8849144412 1 1 0 4701 Inf -1 0.5
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lecorguille
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3804 M425T2872 424.899993896484 424.899993896484 424.899993896484 2872.09955249099 2872.09955249099 2872.09955249099 1 1 0 133 Inf -1 0.5
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lecorguille
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3805 M425T3072 425 425 425 3072.37676096677 3072.37676096677 3072.37676096677 1 0 1 2433 3.18937973376537 2.09753268246309 0.252443257612979
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lecorguille
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3806 M425T3307 425 425 425 3307.00627849836 3307.00627849836 3307.00627849836 1 0 1 542 Inf 1.27995039984677 0.422220106563463
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lecorguille
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3807 M425T3115 425 425 425 3114.83472387554 3114.83472387554 3114.83472387554 1 1 0 5974 2.00007551990701 -0.447233858954316 0.711712043198423
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lecorguille
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3808 M425T3211 425 425 425 3211.19905219813 3211.19905219813 3211.19905219813 1 0 1 4323 Inf 3.20253864417091 0.192678814123566
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lecorguille
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diff changeset
3809 M425T3734 425 425 425 3733.93024081276 3733.93024081276 3733.93024081276 1 1 0 3568 Inf -1 0.5
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lecorguille
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3810 M425T3181 425 425 425 3181.41748468921 3181.41748468921 3181.41748468921 1 1 0 40 19.2199653748938 -2.61822851924777 0.224052344299863
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lecorguille
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3811 M425T3853 425.100006103516 425.100006103516 425.100006103516 3853.06616177411 3853.06616177411 3853.06616177411 1 1 0 1386 1.69597501796723 -0.371242293212987 0.758191223963921
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lecorguille
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3812 M425T4182 425.100006103516 425.100006103516 425.100006103516 4181.84656269688 4181.84656269688 4181.84656269688 1 1 0 6008 Inf -1 0.5
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lecorguille
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3813 M425T3231 425.100006103516 425.100006103516 425.100006103516 3231.48982766231 3231.48982766231 3231.48982766231 1 1 0 2717 7.98213105164705 -1.09151941750291 0.4718888239121
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lecorguille
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3814 M425T3657 425.200012207031 425.200012207031 425.200012207031 3656.55574542826 3656.55574542826 3656.55574542826 1 1 0 47 2.26428196093763 -0.935132456520573 0.516945696185383
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lecorguille
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3815 M425T3002 425.200012207031 425.200012207031 425.200012207031 3001.99216862897 3001.99216862897 3001.99216862897 1 0 1 4090 1.30085931915231 0.274616846819005 0.818205899206338
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lecorguille
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3816 M425T2950 425.200012207031 425.200012207031 425.200012207031 2950.139046458 2950.139046458 2950.139046458 1 1 0 [69][M+1]- 70 6.79751724642769 -1.02157878938087 0.491826340772051
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lecorguille
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3817 M425T3077 425.300018310547 425.300018310547 425.300018310547 3077.06004455804 3077.06004455804 3077.06004455804 1 0 1 5538 Inf 1 0.5
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lecorguille
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3818 M425T3722 425.300018310547 425.300018310547 425.300018310547 3721.5387075449 3721.5387075449 3721.5387075449 1 1 0 3446 Inf -1 0.5
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lecorguille
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diff changeset
3819 M425T2756 425.300018310547 425.300018310547 425.300018310547 2756.18641096809 2756.18641096809 2756.18641096809 1 0 1 5822 4.96189570959518 0.782726449896774 0.569087512326011
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lecorguille
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3820 M425T3239 425.300018310547 425.300018310547 425.300018310547 3239.38536416913 3239.38536416913 3239.38536416913 1 0 1 3467 Inf 1 0.5
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lecorguille
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3821 M426T3175 425.5 425.5 425.5 3175.0253700214 3175.0253700214 3175.0253700214 1 0 1 752 Inf 1 0.5
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lecorguille
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3822 M426T4392 425.800018310547 425.800018310547 425.800018310547 4391.71522276304 4391.71522276304 4391.71522276304 1 1 0 323 Inf -1 0.5
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lecorguille
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3823 M426T3310 425.899993896484 425.899993896484 425.899993896484 3309.99724528819 3309.99724528819 3309.99724528819 1 1 0 543 1.63963343408325 -0.333052179086759 0.776474773151268
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lecorguille
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3824 M426T2522 425.899993896484 425.899993896484 425.899993896484 2521.76928676082 2521.76928676082 2521.76928676082 1 1 0 5052 Inf -1 0.5
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lecorguille
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3825 M426T3399 425.899993896484 425.899993896484 425.899993896484 3399.03600389222 3399.03600389222 3399.03600389222 1 1 0 1327 Inf -1 0.5
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lecorguille
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3826 M426T2893 426 426 426 2892.58722465327 2892.58722465327 2892.58722465327 1 1 0 3830 1.15536471793374 -0.127200097881469 0.916331987932103
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lecorguille
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3827 M426T3692 426 426 426 3691.86366065346 3691.86366065346 3691.86366065346 1 0 1 598 Inf 1 0.5
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lecorguille
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3828 M426T2633 426 426 426 2632.9421830118 2632.9421830118 2632.9421830118 1 0 1 2620 2.63563716735943 2.48807740703261 0.130632261119815
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lecorguille
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3829 M426T2924 426 426 426 2923.6821033927 2923.6821033927 2923.6821033927 1 1 0 [M+Cl]- 391.031 [M-H]- 427.008 60 3.072351753394 -0.641396877766672 0.621186924449264
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lecorguille
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3830 M426T3458 426 426 426 3457.87780203005 3457.87780203005 3457.87780203005 1 0 1 1276 2.06125412738673 0.51226421094102 0.697252484379177
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lecorguille
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3831 M426T4118 426 426 426 4117.72633782937 4117.72633782937 4117.72633782937 1 0 1 4561 Inf 1 0.5
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lecorguille
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3832 M426T4209 426 426 426 4208.96236921601 4208.96236921601 4208.96236921601 1 0 1 4931 Inf 1 0.5
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lecorguille
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3833 M426T4377 426 426 426 4376.84415089905 4376.84415089905 4376.84415089905 1 0 1 6216 Inf 1 0.5
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lecorguille
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3834 M426T3547 426 426 426 3546.98944553125 3546.98944553125 3546.98944553125 1 0 1 44 3.16335246580235 0.674805746758783 0.617337777700063
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lecorguille
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3835 M426T3207 426 426 426 3206.50913659474 3206.50913659474 3206.50913659474 1 0 1 4324 3.95595155037366 0.724429332268435 0.589441343314112
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lecorguille
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3836 M426T3393 426 426 426 3392.82907241035 3392.82907241035 3392.82907241035 1 1 0 489 Inf -1 0.5
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lecorguille
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3837 M426T3011 426.100006103516 426.100006103516 426.100006103516 3010.50467320994 3008.21372989252 3013.36635443376 4 2 2 [70][M]- [M-H]- 427.112 37 1.03255688705188 0.335586534578857 0.782440734242469
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lecorguille
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3838 M426T4307 426.100006103516 426.100006103516 426.100006103516 4307.20822276304 4307.20822276304 4307.20822276304 1 1 0 275 Inf -1 0.5
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lecorguille
parents:
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3839 M426T4113 426.200012207031 426.200012207031 426.200012207031 4112.62286095321 4112.62286095321 4112.62286095321 1 1 0 [M+Cl]- 391.233 43 83.3855984933227 -1.03563601046249 0.488842528534325
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lecorguille
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3840 M426T2845 426.200012207031 426.200012207031 426.200012207031 2844.89379581084 2844.89379581084 2844.89379581084 1 1 0 5523 1.46765519261479 -0.554554374109256 0.677606412786368
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lecorguille
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3841 M426T4136 426.200012207031 426.200012207031 426.200012207031 4136.24529906271 4136.24529906271 4136.24529906271 1 1 0 99 142.275768361757 -1.03784494349481 0.488178288741835
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lecorguille
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3842 M426T3749 426.200012207031 426.200012207031 426.200012207031 3748.75724616318 3748.75724616318 3748.75724616318 1 0 1 [M-H-CH4]- 443.233 14 44.124852154143 0.981349610490954 0.505895420110995
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lecorguille
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3843 M426T2537 426.200012207031 426.200012207031 426.200012207031 2537.41828676082 2537.41828676082 2537.41828676082 1 1 0 5912 5.067704906307 -0.787486715173407 0.567483130704371
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lecorguille
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3844 M426T3856 426.200012207031 426.200012207031 426.200012207031 3855.84399832511 3855.84399832511 3855.84399832511 1 1 0 [71][M]- [M+Cl]- 391.234 21 2.04183030071048 -0.462099164659121 0.703774827013826
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3845 M426T4176 426.200012207031 426.200012207031 426.200012207031 4175.56395558154 4175.56395558154 4175.56395558154 1 1 0 115 82.0774814538669 -1.01751460479382 0.494459155160989
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3846 M426T4210 426.200012207031 426.200012207031 426.200012207031 4210.11191411352 4210.11191411352 4210.11191411352 1 1 0 140 679.122738730428 -1.00539068980667 0.498288703297823
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lecorguille
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3847 M426T3055 426.200012207031 426.200012207031 426.200012207031 3055.47864641577 3055.47864641577 3055.47864641577 1 0 1 3493 3.16417715144386 2.47341040778997 0.187829858453305
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lecorguille
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3848 M426T3819 426.200012207031 426.200012207031 426.200012207031 3819.03452474863 3819.03452474863 3819.03452474863 1 1 0 1885 1.02287287592532 -0.0161139268997675 0.988606669875219
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lecorguille
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3849 M426T3553 426.300018310547 426.300018310547 426.300018310547 3553.17435185478 3549.57444136163 3556.77426234792 2 1 1 5991 1.32804962095115 -0.197329879157866 0.863026190920139
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lecorguille
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3850 M426T2713 426.300018310547 426.300018310547 426.300018310547 2713.11962324477 2713.11962324477 2713.11962324477 1 1 0 2495 Inf -1 0.5
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lecorguille
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3851 M426T3286 426.300018310547 426.300018310547 426.300018310547 3286.26441641646 3286.26441641646 3286.26441641646 1 1 0 3796 6.22654555872782 -3.39556503280983 0.0794645589279734
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3852 M426T3781 426.300018310547 426.300018310547 426.300018310547 3780.51173757869 3780.51173757869 3780.51173757869 1 1 0 3676 3.14553821306269 -0.727785807057326 0.578204451682182
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3853 M426T3839 426.399993896484 426.399993896484 426.399993896484 3838.67095770774 3838.67095770774 3838.67095770774 1 0 1 3167 1.75290472280155 0.37307843454341 0.752840915574475
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lecorguille
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3854 M426T2807 426.399993896484 426.399993896484 426.399993896484 2807.34070021133 2807.34070021133 2807.34070021133 1 0 1 6030 Inf 1.09494775031924 0.471166689539252
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lecorguille
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3855 M426T3366 426.399993896484 426.399993896484 426.399993896484 3366.34966150958 3366.34966150958 3366.34966150958 1 0 1 4659 4.60792876393062 3.366232345791 0.137371054285804
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lecorguille
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3856 M426T4146 426.399993896484 426.399993896484 426.399993896484 4146.10802128113 4146.10802128113 4146.10802128113 1 0 1 5616 Inf 3.30654131427691 0.186965938589309
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lecorguille
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3857 M426T4389 426.5 426.5 426.5 4389.36415089905 4389.36415089905 4389.36415089905 1 0 1 6240 Inf 1 0.5
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lecorguille
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3858 M426T4227 426.5 426.5 426.5 4227.0757250527 4227.0757250527 4227.0757250527 1 1 0 5423 6.95922379495578 -0.847599894719728 0.547808200871697
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lecorguille
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3859 M427T2736 426.800018310547 426.800018310547 426.800018310547 2735.86690351336 2735.86690351336 2735.86690351336 1 0 1 2496 Inf 1 0.5
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lecorguille
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3860 M427T2584 426.899993896484 426.899993896484 426.899993896484 2583.50608488001 2583.50608488001 2583.50608488001 1 0 1 5743 6.10172674017987 1.27979135232578 0.402830036632662
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lecorguille
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3861 M427T4215 426.899993896484 426.899993896484 426.899993896484 4215.14822956106 4215.14822956106 4215.14822956106 1 0 1 5321 Inf 1 0.5
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lecorguille
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3862 M427T2869 427 427 427 2868.96622900969 2868.96622900969 2868.96622900969 1 1 0 3649 4.58869756661537 -0.764138449056815 0.575430095642339
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lecorguille
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3863 M427T2686 427 427 427 2685.68075810517 2685.68075810517 2685.68075810517 1 0 1 [M+Cl+HCOOH]- 346.029 [M-H+HCOOH]- 382.006 6 1.02614497347879 -0.0784312041215913 0.945419578695757
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lecorguille
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3864 M427T4144 427 427 427 4143.9632134336 4143.9632134336 4143.9632134336 1 0 1 5833 Inf 1 0.5
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lecorguille
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3865 M427T3761 427 427 427 3761.35736156645 3761.35736156645 3761.35736156645 1 1 0 993 Inf -1 0.5
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3866 M427T3008 427.100006103516 427.100006103516 427.100006103516 3008.32365642662 3008.21372989252 3014.9139246582 3 1 2 [70][M+1]- 37 1.03926850888227 -0.495395972570398 0.686957489501516
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lecorguille
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3867 M427T3674 427.100006103516 427.100006103516 427.100006103516 3673.5402322499 3673.5402322499 3673.5402322499 1 0 1 3705 1.0050065391588 -0.0117834617519098 0.992248265429782
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lecorguille
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3868 M427T2642 427.100006103516 427.100006103516 427.100006103516 2642.46037753233 2642.46037753233 2642.46037753233 1 0 1 5668 1.43244037398941 -0.40322241582216 0.725851512385587
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lecorguille
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diff changeset
3869 M427T3749 427.200012207031 427.200012207031 427.200012207031 3748.75724616318 3748.75724616318 3748.75724616318 1 0 1 [M-H-CH3]- 443.233 14 11.3500344977623 0.94395956043677 0.517584585895206
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lecorguille
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3870 M427T3867 427.200012207031 427.200012207031 427.200012207031 3866.89893599656 3866.89893599656 3866.89893599656 1 1 0 [71][M+1]- 21 5.04568341327331 -0.829776442180489 0.552468938116059
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lecorguille
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diff changeset
3871 M427T3292 427.300018310547 427.300018310547 427.300018310547 3292.19880652399 3292.19880652399 3292.19880652399 1 0 1 5760 1.46901423524008 -0.445711875442191 0.719742004157313
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lecorguille
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3872 M427T4312 427.300018310547 427.300018310547 427.300018310547 4311.90222276304 4311.90222276304 4311.90222276304 1 1 0 277 Inf -1 0.5
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lecorguille
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3873 M427T2544 427.300018310547 427.300018310547 427.300018310547 2543.67828676082 2543.67828676082 2543.67828676082 1 1 0 5161 1.07173396674584 -0.0489379392280067 0.965435185205776
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lecorguille
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diff changeset
3874 M427T4190 427.300018310547 427.300018310547 427.300018310547 4190.4073075892 4190.4073075892 4190.4073075892 1 0 1 6080 2.29948857332805 0.518236938495143 0.675738509819269
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lecorguille
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3875 M427T2536 427.399993896484 427.399993896484 427.399993896484 2535.707668269 2535.707668269 2535.707668269 1 0 1 5781 Inf 1 0.5
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lecorguille
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3876 M427T4010 427.399993896484 427.399993896484 427.399993896484 4010.43775329514 4010.43775329514 4010.43775329514 1 0 1 5223 Inf 1 0.5
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lecorguille
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3877 M427T3623 427.399993896484 427.399993896484 427.399993896484 3622.72716675662 3622.72716675662 3622.72716675662 1 0 1 1616 Inf 1 0.5
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lecorguille
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3878 M428T2942 427.5 427.5 427.5 2942.00208742554 2942.00208742554 2942.00208742554 1 0 1 2808 Inf 1 0.5
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lecorguille
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3879 M428T2958 427.5 427.5 427.5 2957.94240686028 2957.94240686028 2957.94240686028 1 1 0 3259 Inf -1 0.5
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lecorguille
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3880 M428T2751 427.800018310547 427.800018310547 427.800018310547 2751.02592154745 2751.02592154745 2751.02592154745 1 0 1 4354 Inf 1 0.5
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lecorguille
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3881 M428T2668 427.899993896484 427.899993896484 427.899993896484 2668.46283611837 2668.46283611837 2668.46283611837 1 1 0 4048 Inf -1 0.5
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lecorguille
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3882 M428T2585 427.899993896484 427.899993896484 427.899993896484 2585.07108488001 2585.07108488001 2585.07108488001 1 0 1 5744 Inf 1 0.5
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lecorguille
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3883 M428T4157 428 428 428 4157.15238308892 4157.15238308892 4157.15238308892 1 0 1 283 Inf 1 0.5
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lecorguille
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3884 M428T4171 428 428 428 4170.72837973241 4170.72837973241 4170.72837973241 1 1 0 5926 9.339682873283 -0.887855304521931 0.535080637784445
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lecorguille
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3885 M428T3826 428 428 428 3826.36034427007 3826.36034427007 3826.36034427007 1 1 0 1886 7.07156892430007 -0.850130638565705 0.5469997834316
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lecorguille
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diff changeset
3886 M428T4131 428.100006103516 428.100006103516 428.100006103516 4130.75998509112 4130.00265569564 4131.5173144866 2 1 1 1497 5.21206682847233 -0.80747809647829 0.56719818076216
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lecorguille
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3887 M428T2636 428.100006103516 428.100006103516 428.100006103516 2636.01498039087 2636.01498039087 2636.01498039087 1 1 0 2626 4.98176946026037 -0.922604964400486 0.525479298957289
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lecorguille
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3888 M428T3473 428.300018310547 428.300018310547 428.300018310547 3473.05796440376 3473.05796440376 3473.05796440376 1 1 0 31 1.98681263942981 -0.495095395234424 0.706499640313511
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lecorguille
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3889 M428T4343 428.300018310547 428.300018310547 428.300018310547 4343.31274443202 4343.31274443202 4343.31274443202 1 0 1 6107 Inf 1 0.5
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lecorguille
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3890 M428T3169 428.300018310547 428.300018310547 428.300018310547 3169.04072732697 3169.04072732697 3169.04072732697 1 0 1 778 2.65199323019755 0.767020503527464 0.583423263768417
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lecorguille
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3891 M428T4325 428.399993896484 428.399993896484 428.399993896484 4324.53274443202 4324.53274443202 4324.53274443202 1 0 1 329 Inf 1 0.5
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lecorguille
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3892 M428T4111 428.399993896484 428.399993896484 428.399993896484 4111.42132545829 4111.42132545829 4111.42132545829 1 0 1 2307 Inf 1.18581549791346 0.446010954075838
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lecorguille
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3893 M428T3703 428.399993896484 428.399993896484 428.399993896484 3703.07760757611 3703.07760757611 3703.07760757611 1 1 0 1180 6.3642735065498 -0.832656841409617 0.55260991799717
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lecorguille
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3894 M429T3089 429 429 429 3088.65301316981 3088.65301316981 3088.65301316981 1 0 1 5955 6.13274520453867 0.826031548458521 0.554755675988992
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lecorguille
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3895 M429T3858 429 429 429 3857.79163814401 3857.79163814401 3857.79163814401 1 1 0 1387 Inf -1 0.5
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lecorguille
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3896 M429T3699 429 429 429 3698.53175380367 3698.53175380367 3698.53175380367 1 1 0 109 7.31362882897439 -1.7812571235689 0.297040650976199
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lecorguille
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3897 M429T3865 429.100006103516 429.100006103516 429.100006103516 3864.64613878686 3864.64613878686 3864.64613878686 1 0 1 1388 3.20231628010582 0.9923985432426 0.45543641623824
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lecorguille
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3898 M429T4089 429.100006103516 429.100006103516 429.100006103516 4089.35826014922 4089.35826014922 4089.35826014922 1 0 1 4982 Inf 1.72541348440201 0.33439273993161
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lecorguille
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3899 M429T4173 429.100006103516 429.100006103516 429.100006103516 4173.39397553662 4173.39397553662 4173.39397553662 1 0 1 4397 3.09253066842617 0.92209748425903 0.483336787912374
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lecorguille
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3900 M429T3886 429.200012207031 429.200012207031 429.200012207031 3886.30068197219 3883.04786546855 3890.4017301891 4 2 2 [72][M]- 2219 5.25932624878098 1.24730805352736 0.425778202944696
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lecorguille
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3901 M429T4033 429.200012207031 429.200012207031 429.200012207031 4033.20328963011 4032.62108025737 4033.78549900285 2 1 1 92 1.34132113403957 0.347395950151495 0.775383952219308
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lecorguille
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3902 M429T4072 429.200012207031 429.200012207031 429.200012207031 4071.84831081236 4068.55467940059 4075.14194222414 2 2 0 [73][M]- 96 2.18295935822178 -0.929817899796948 0.512679806334532
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lecorguille
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3903 M429T2700 429.200012207031 429.200012207031 429.200012207031 2700.3977849365 2700.3977849365 2700.3977849365 1 0 1 4869 3.94598390977653 1.24216363482489 0.381596302935354
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lecorguille
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3904 M429T2945 429.200012207031 429.200012207031 429.200012207031 2945.46102116048 2945.46102116048 2945.46102116048 1 1 0 [M-2H+Na]- 408.212 70 5.34838532027778 -0.993215040210498 0.498464265222615
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lecorguille
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3905 M429T3978 429.200012207031 429.200012207031 429.200012207031 3978.24414308204 3978.24414308204 3978.24414308204 1 1 0 2074 1.3295778475356 0.409356739837859 0.74977758069995
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lecorguille
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3906 M429T2966 429.200012207031 429.200012207031 429.200012207031 2965.75289998914 2965.75289998914 2965.75289998914 1 1 0 3233 4.60971010092125 -0.852674234978869 0.550035016092338
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lecorguille
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3907 M429T3917 429.300018310547 429.300018310547 429.300018310547 3917.1285969089 3911.55024985287 3922.70694396493 2 1 1 5142 1.5744903902155 0.308002545967296 0.791742450269072
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lecorguille
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3908 M429T2713 429.300018310547 429.300018310547 429.300018310547 2712.81551704119 2712.81551704119 2712.81551704119 1 0 1 2449 Inf 1 0.5
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lecorguille
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3909 M429T4088 429.300018310547 429.300018310547 429.300018310547 4087.68938648022 4087.68938648022 4087.68938648022 1 1 0 143 3.79953249550915 -0.721183011889699 0.594202553818087
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lecorguille
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3910 M429T3272 429.300018310547 429.300018310547 429.300018310547 3271.9328810725 3271.9328810725 3271.9328810725 1 1 0 5019 Inf -1 0.5
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lecorguille
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3911 M429T3959 429.300018310547 429.300018310547 429.300018310547 3958.76909576651 3958.76909576651 3958.76909576651 1 0 1 5460 3.15300794121501 0.671267229751248 0.617634665923491
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lecorguille
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3912 M429T4183 429.300018310547 429.300018310547 429.300018310547 4182.67582713382 4182.67582713382 4182.67582713382 1 0 1 5992 1.14804401667287 -0.108517003776026 0.923540581068107
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lecorguille
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3913 M429T3309 429.399993896484 429.399993896484 429.399993896484 3309.19933724944 3309.19933724944 3309.19933724944 1 0 1 544 4.94546144296779 0.781968338791443 0.569343747770354
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lecorguille
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3914 M429T3417 429.399993896484 429.399993896484 429.399993896484 3416.66862409634 3416.66862409634 3416.66862409634 1 0 1 874 Inf 1.35305167594965 0.405188863410147
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lecorguille
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3915 M429T3459 429.399993896484 429.399993896484 429.399993896484 3458.75015890217 3458.75015890217 3458.75015890217 1 1 0 1277 Inf -1.31223953926629 0.414549223568986
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lecorguille
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3916 M430T2799 429.800018310547 429.800018310547 429.800018310547 2799.49239024527 2799.49239024527 2799.49239024527 1 0 1 3936 6.00475819191591 0.822142807353769 0.556020343784765
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lecorguille
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3917 M430T3856 429.899993896484 429.899993896484 429.899993896484 3856.01374663275 3856.01374663275 3856.01374663275 1 0 1 1389 Inf 1 0.5
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3918 M430T2778 429.899993896484 429.899993896484 429.899993896484 2777.62270382815 2777.62270382815 2777.62270382815 1 0 1 112 Inf 2.3231295371869 0.258773844212509
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lecorguille
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3919 M430T2808 429.899993896484 429.899993896484 429.899993896484 2808.16172237469 2808.16172237469 2808.16172237469 1 1 0 5947 Inf -1 0.5
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lecorguille
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3920 M430T4143 430 430 430 4142.54286529035 4142.54286529035 4142.54286529035 1 1 0 4232 Inf -1 0.5
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lecorguille
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3921 M430T4130 430 430 430 4130.00265569564 4130.00265569564 4130.00265569564 1 0 1 1498 2.97702228638362 0.629527196270258 0.626033477365559
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lecorguille
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3922 M430T2630 430 430 430 2629.76901829783 2629.76901829783 2629.76901829783 1 0 1 2621 1.11427794996134 0.164179388228249 0.885219083887186
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lecorguille
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3923 M430T3758 430 430 430 3757.96083418913 3757.96083418913 3757.96083418913 1 0 1 994 Inf 1 0.5
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lecorguille
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3924 M430T2684 430.100006103516 430.100006103516 430.100006103516 2683.84650308751 2682.82780937765 2684.41623929172 4 2 2 [74][M]- [M-H+NaCOOH]- 363.113 6 1.0398274720893 -0.519527494241804 0.660479557434315
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3925 M430T3888 430.200012207031 430.200012207031 430.200012207031 3888.20586232792 3884.39550161646 3891.96202504143 3 1 2 [72][M+1]- 2220 8.80690074347535 1.34912074342808 0.40603917948714
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3926 M430T4075 430.200012207031 430.200012207031 430.200012207031 4075.14194222414 4075.14194222414 4075.14194222414 1 1 0 [73][M+1]- 96 3.43098511458729 -3.90310132785239 0.115757981582946
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3927 M430T2557 430.200012207031 430.200012207031 430.200012207031 2557.46997459635 2557.46997459635 2557.46997459635 1 1 0 3076 7.50514125220269 -1.55717110195502 0.343651336835563
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3928 M430T3880 430.300018310547 430.300018310547 430.300018310547 3879.88611692625 3879.88611692625 3879.88611692625 1 1 0 4757 20.450413023753 -1.09574948354997 0.470031605660931
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lecorguille
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diff changeset
3929 M430T3228 430.300018310547 430.300018310547 430.300018310547 3228.41270579453 3228.41270579453 3228.41270579453 1 0 1 2718 3.1030507954206 1.0292424730452 0.435569266925641
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lecorguille
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3930 M431T3964 430.800018310547 430.800018310547 430.800018310547 3963.69654968976 3963.69654968976 3963.69654968976 1 1 0 2038 Inf -1 0.5
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lecorguille
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3931 M431T3403 430.800018310547 430.800018310547 430.800018310547 3403.38646124844 3403.38646124844 3403.38646124844 1 1 0 1328 Inf -1 0.5
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lecorguille
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diff changeset
3932 M431T2640 430.800018310547 430.800018310547 430.800018310547 2639.65435349467 2639.65435349467 2639.65435349467 1 1 0 5857 2.86688897634354 -0.614858738195259 0.632138338988242
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lecorguille
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3933 M431T3332 430.899993896484 430.899993896484 430.899993896484 3332.36652959154 3332.36652959154 3332.36652959154 1 0 1 1112 Inf 1 0.5
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lecorguille
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3934 M431T3865 430.899993896484 430.899993896484 430.899993896484 3865.47422517578 3865.47422517578 3865.47422517578 1 0 1 1390 Inf 1 0.5
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lecorguille
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diff changeset
3935 M431T3192 430.899993896484 430.899993896484 430.899993896484 3192.49467842718 3192.49467842718 3192.49467842718 1 0 1 30 Inf 1.42241214040633 0.390093462161522
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lecorguille
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3936 M431T3691 430.899993896484 430.899993896484 430.899993896484 3690.69884839 3690.69884839 3690.69884839 1 1 0 599 Inf -1 0.5
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lecorguille
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diff changeset
3937 M431T3542 430.899993896484 430.899993896484 430.899993896484 3542.30607326506 3542.30607326506 3542.30607326506 1 0 1 2347 Inf 1 0.5
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lecorguille
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3938 M431T3432 430.899993896484 430.899993896484 430.899993896484 3431.67844070908 3431.67844070908 3431.67844070908 1 1 0 4917 Inf -3.78375234518986 0.164489975092316
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lecorguille
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3939 M431T2888 431 431 431 2888.47938904019 2888.47938904019 2888.47938904019 1 1 0 3831 Inf -1 0.5
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lecorguille
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3940 M431T3549 431 431 431 3548.55320075327 3548.55320075327 3548.55320075327 1 0 1 2348 1.66501756240542 0.34239779063773 0.77087090660645
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lecorguille
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3941 M431T2718 431 431 431 2717.50256830224 2717.50256830224 2717.50256830224 1 0 1 49 2.82698918704201 1.63094850250518 0.285506995490761
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lecorguille
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3942 M431T2584 431 431 431 2584.36728676082 2584.36728676082 2584.36728676082 1 1 0 201 2.13450904489657 -1.12443600862467 0.411465226787425
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lecorguille
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3943 M431T2663 431 431 431 2663.09078109186 2663.09078109186 2663.09078109186 1 1 0 2266 17.5130739585488 -0.984527357126049 0.504666981282996
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lecorguille
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diff changeset
3944 M431T2685 431.100006103516 431.100006103516 431.100006103516 2685.46794403878 2681.23206234307 2687.58718990559 4 2 2 [74][M+1]- 6 1.12890408577475 -0.870057182290933 0.544135511533987
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lecorguille
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3945 M431T4285 431.100006103516 431.100006103516 431.100006103516 4284.51215089905 4284.51215089905 4284.51215089905 1 0 1 274 Inf 1 0.5
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lecorguille
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3946 M431T3912 431.100006103516 431.100006103516 431.100006103516 3912.20437656731 3912.20437656731 3912.20437656731 1 1 0 135 2.51434066540087 -0.827704753854027 0.506761869568021
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lecorguille
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diff changeset
3947 M431T3752 431.100006103516 431.100006103516 431.100006103516 3751.82505250554 3751.82505250554 3751.82505250554 1 1 0 1060 6.92432656078424 -1.01461240678151 0.493995930725871
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lecorguille
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diff changeset
3948 M431T3892 431.200012207031 431.200012207031 431.200012207031 3891.80834633742 3890.70325192937 3892.91344074546 2 0 2 4895 5.21185378008027 1.10580439953136 0.467223714678947
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lecorguille
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diff changeset
3949 M431T4074 431.200012207031 431.200012207031 431.200012207031 4073.57332009318 4073.57332009318 4073.57332009318 1 1 0 [73][M+2]- 3856 2.82855702879911 -1.95806528193569 0.228076181349282
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lecorguille
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diff changeset
3950 M431T2754 431.300018310547 431.300018310547 431.300018310547 2754.1264137859 2748.99251369626 2759.26031387555 2 1 1 4355 1.88976295998478 -0.416158738942514 0.728513615161471
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lecorguille
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diff changeset
3951 M431T3189 431.300018310547 431.300018310547 431.300018310547 3189.31992600977 3189.31992600977 3189.31992600977 1 0 1 2197 7.83160107429086 3.21104267657093 0.119403194119997
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lecorguille
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diff changeset
3952 M431T3205 431.300018310547 431.300018310547 431.300018310547 3204.94624068204 3204.94624068204 3204.94624068204 1 0 1 4280 3.59154504354913 1.51963680843857 0.355404776463229
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
3953 M431T3006 431.300018310547 431.300018310547 431.300018310547 3006.4282355155 3006.4282355155 3006.4282355155 1 1 0 4091 Inf -1 0.5
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lecorguille
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diff changeset
3954 M431T2799 431.300018310547 431.300018310547 431.300018310547 2799.49239024527 2799.49239024527 2799.49239024527 1 0 1 3936 Inf 1.79985765229578 0.322850308688827
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lecorguille
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3955 M431T3135 431.300018310547 431.300018310547 431.300018310547 3134.57459104471 3134.57459104471 3134.57459104471 1 0 1 4999 Inf 1 0.5
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lecorguille
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diff changeset
3956 M431T3851 431.300018310547 431.300018310547 431.300018310547 3851.08551786741 3851.08551786741 3851.08551786741 1 1 0 [M+Cl+HCOOH]- 350.312 21 6.1401221866636 -0.960842287488382 0.503905962564948
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
3957 M431T3757 431.399993896484 431.399993896484 431.399993896484 3756.54933342917 3756.54933342917 3756.54933342917 1 0 1 938 Inf 1 0.5
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lecorguille
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diff changeset
3958 M431T3948 431.399993896484 431.399993896484 431.399993896484 3948.0247049645 3948.0247049645 3948.0247049645 1 1 0 3738 Inf -1 0.5
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lecorguille
parents:
diff changeset
3959 M432T2840 431.800018310547 431.800018310547 431.800018310547 2840.34223529104 2840.34223529104 2840.34223529104 1 0 1 4637 Inf 1 0.5
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lecorguille
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3960 M432T3752 431.899993896484 431.899993896484 431.899993896484 3751.82505250554 3751.82505250554 3751.82505250554 1 1 0 1061 Inf -1 0.5
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lecorguille
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3961 M432T4018 431.899993896484 431.899993896484 431.899993896484 4018.23186265825 4018.23186265825 4018.23186265825 1 0 1 305 2.09096881568895 0.47069355080502 0.699452392716753
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lecorguille
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3962 M432T2811 431.899993896484 431.899993896484 431.899993896484 2810.65916155748 2810.65916155748 2810.65916155748 1 0 1 3298 5.21073937757422 -1.461036173375 0.343300777311038
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
3963 M432T2872 432 432 432 2872.09955249099 2872.09955249099 2872.09955249099 1 1 0 133 Inf -1.08911972354269 0.472858903424697
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lecorguille
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diff changeset
3964 M432T2961 432 432 432 2960.60185152721 2960.60185152721 2960.60185152721 1 0 1 3260 1.45884270827077 0.259426925129987 0.822313815546252
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
3965 M432T3254 432 432 432 3254.33971258947 3254.33971258947 3254.33971258947 1 1 0 1919 19.5236457940601 -3.71360356056341 0.152186606442279
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3966 M432T3632 432 432 432 3631.97435968479 3631.97435968479 3631.97435968479 1 1 0 2362 Inf -1 0.5
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lecorguille
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3967 M432T3211 432 432 432 3211.49389160157 3211.49389160157 3211.49389160157 1 1 0 4286 Inf -8.44479424760409 0.0750366318945983
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lecorguille
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3968 M432T4051 432 432 432 4051.19200669252 4051.19200669252 4051.19200669252 1 1 0 3404 Inf -3.72466388167626 0.166982268165738
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lecorguille
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diff changeset
3969 M432T4074 432.300018310547 432.300018310547 432.300018310547 4073.57332009318 4073.57332009318 4079.903008509 3 1 1 3852 2.25141631137931 -1.19555814978751 0.390442182076238
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lecorguille
parents:
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3970 M432T4116 432.300018310547 432.300018310547 432.300018310547 4116.15002794601 4116.15002794601 4116.15002794601 1 0 1 4562 17.6117769354923 0.941703013444769 0.518300518864657
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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3971 M432T3304 432.300018310547 432.300018310547 432.300018310547 3303.94373016607 3303.94373016607 3303.94373016607 1 1 0 5388 2.67956326398508 -0.587243395843775 0.643988829104874
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lecorguille
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3972 M432T3098 432.300018310547 432.300018310547 432.300018310547 3097.59855190873 3097.59855190873 3097.59855190873 1 1 0 5367 Inf -1 0.5
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lecorguille
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3973 M432T2858 432.300018310547 432.300018310547 432.300018310547 2857.65504889618 2857.65504889618 2857.65504889618 1 0 1 4261 2.18728513365591 0.493665490486447 0.687804945231647
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lecorguille
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3974 M432T4163 432.300018310547 432.300018310547 432.300018310547 4163.46499093421 4163.46499093421 4163.46499093421 1 0 1 6115 6.4917628668761 0.836097029800552 0.551499959859891
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lecorguille
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3975 M432T4147 432.300018310547 432.300018310547 432.300018310547 4147.06511125254 4147.06511125254 4147.06511125254 1 0 1 5617 Inf 1 0.5
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lecorguille
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3976 M432T3471 432.300018310547 432.300018310547 432.300018310547 3471.47237589688 3471.47237589688 3471.47237589688 1 1 0 1767 3.88549619544934 0.80849960553953 0.567064288506306
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lecorguille
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3977 M432T4193 432.399993896484 432.399993896484 432.399993896484 4193.4581189828 4193.4581189828 4193.4581189828 1 0 1 6165 4.24333021567832 0.743956434468758 0.582467883080255
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lecorguille
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3978 M432T4008 432.399993896484 432.399993896484 432.399993896484 4008.41622189543 4008.41622189543 4008.41622189543 1 1 0 5204 Inf -1 0.5
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lecorguille
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3979 M433T2877 432.800018310547 432.800018310547 432.800018310547 2876.8071344984 2876.8071344984 2876.8071344984 1 1 0 4734 Inf -1 0.5
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lecorguille
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3980 M433T3728 433 433 433 3727.93766242873 3727.93766242873 3727.93766242873 1 0 1 3536 1.28977359002839 -0.253196563169565 0.829367800189336
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lecorguille
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3981 M433T3883 433 433 433 3883.04786546855 3883.04786546855 3883.04786546855 1 1 0 2244 Inf -1 0.5
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lecorguille
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3982 M433T3563 433 433 433 3562.91785640553 3562.91785640553 3562.91785640553 1 1 0 1673 Inf -1 0.5
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lecorguille
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3983 M433T3675 433 433 433 3675.1008785048 3675.1008785048 3675.1008785048 1 1 0 3692 2.29303832196132 -0.51688360645829 0.676392576035745
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lecorguille
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3984 M433T3615 433 433 433 3615.18616174967 3615.18616174967 3615.18616174967 1 1 0 2561 4.64210052391745 -1.01146624801556 0.476516497302818
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lecorguille
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3985 M433T3574 433.100006103516 433.100006103516 433.100006103516 3573.79058978757 3573.79058978757 3573.79058978757 1 0 1 1674 1.07379416041974 0.0831462032864303 0.946632384999813
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lecorguille
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3986 M433T3805 433.200012207031 433.200012207031 433.200012207031 3805.17497726217 3800.74618974528 3809.60376477907 2 0 2 58 1.03918987409308 -0.0909606425098181 0.940920161129815
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lecorguille
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3987 M433T2694 433.200012207031 433.200012207031 433.200012207031 2693.84129290608 2693.84129290608 2693.84129290608 1 0 1 199 3.12752963251499 0.647943593657387 0.618548844249647
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lecorguille
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3988 M433T2619 433.200012207031 433.200012207031 433.200012207031 2618.50297459635 2618.50297459635 2618.50297459635 1 1 0 2651 2.19583113823199 -0.755684271730821 0.531471038387413
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lecorguille
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3989 M433T2765 433.200012207031 433.200012207031 433.200012207031 2765.28357059722 2765.28357059722 2765.28357059722 1 1 0 3804 Inf -1 0.5
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lecorguille
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3990 M433T3448 433.300018310547 433.300018310547 433.300018310547 3448.42769567721 3448.42769567721 3448.42769567721 1 0 1 2928 4.92763600356732 0.781140191602109 0.569623885185056
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lecorguille
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3991 M433T3291 433.300018310547 433.300018310547 433.300018310547 3291.02454723973 3291.02454723973 3291.02454723973 1 1 0 2113 Inf -1.12129932910498 0.463636649376149
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lecorguille
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diff changeset
3992 M433T3017 433.300018310547 433.300018310547 433.300018310547 3017.48765252941 3017.48765252941 3017.48765252941 1 1 0 2147 10.7047994605362 -4.3539252864832 0.0819376154687985
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
3993 M433T3894 433.300018310547 433.300018310547 433.300018310547 3894.48236990837 3894.48236990837 3894.48236990837 1 0 1 4903 Inf 1.37376075687479 0.400577235670637
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
3994 M433T2898 433.300018310547 433.300018310547 433.300018310547 2898.49046452412 2898.49046452412 2898.49046452412 1 0 1 4776 Inf 1.6333863328016 0.349733460487444
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
3995 M433T3752 433.399993896484 433.399993896484 433.399993896484 3751.87435231748 3751.87435231748 3751.87435231748 1 0 1 1030 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
3996 M433T3511 433.399993896484 433.399993896484 433.399993896484 3510.94211515955 3510.94211515955 3510.94211515955 1 1 0 4526 3.07290246904583 -0.843134511036446 0.519971949883861
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
3997 M433T3590 433.399993896484 433.399993896484 433.399993896484 3590.18495990216 3590.18495990216 3590.18495990216 1 1 0 28 Inf -1.39082887835038 0.396844145522316
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
3998 M434T4086 433.5 433.5 433.5 4086.12110918763 4086.12110918763 4086.12110918763 1 1 0 4961 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
3999 M434T2703 433.800018310547 433.800018310547 433.800018310547 2702.53451424339 2700.09391966008 2704.9751088267 2 1 1 4870 1.02922176539928 -0.0245225561997336 0.983124787045446
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4000 M434T3013 433.899993896484 433.899993896484 433.899993896484 3012.68568999327 3012.68568999327 3012.68568999327 1 1 0 2084 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4001 M434T3377 433.899993896484 433.899993896484 433.899993896484 3377.39784471179 3377.39784471179 3377.39784471179 1 1 0 1572 Inf -9.55123007779898 0.0664112144900342
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4002 M434T3524 434 434 434 3524.45539948538 3524.45539948538 3524.45539948538 1 1 0 407 3.78651755715247 -0.71151072199424 0.59415001016334
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lecorguille
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diff changeset
4003 M434T3114 434 434 434 3114.02104468809 3114.02104468809 3114.02104468809 1 0 1 5975 1.22276684269061 0.141026737277953 0.901219558291652
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4004 M434T3750 434 434 434 3750.04701872402 3750.04701872402 3750.04701872402 1 0 1 1062 1.67767451389249 -0.34697414873141 0.768145557027805
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lecorguille
parents:
diff changeset
4005 M434T4125 434.100006103516 434.100006103516 434.100006103516 4124.54257403263 4119.14363200002 4129.94151606524 2 1 1 1464 1.70396049789931 1.06155315930196 0.455424169342934
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4006 M434T4037 434.100006103516 434.100006103516 434.100006103516 4036.91062955396 4036.91062955396 4036.91062955396 1 0 1 3770 1.51655524029608 0.718037774212048 0.547378658179443
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4007 M434T4090 434.200012207031 434.200012207031 434.200012207031 4089.68382733714 4089.68382733714 4089.68382733714 1 0 1 4960 1.47543907199127 -0.413578964839222 0.728323665977134
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4008 M434T4066 434.200012207031 434.200012207031 434.200012207031 4066.41996987292 4066.41996987292 4066.41996987292 1 0 1 3893 14.7796258233346 3.31628313705374 0.164302695124946
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4009 M434T3247 434.200012207031 434.200012207031 434.200012207031 3247.23300850549 3247.23300850549 3247.23300850549 1 0 1 1900 1.04458756343871 -0.0379400870754345 0.973778728592604
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4010 M434T3764 434.300018310547 434.300018310547 434.300018310547 3764.44114521766 3764.34021352811 3764.54207690721 2 1 1 954 1.15926310340505 -0.124100856887533 0.913042411850099
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4011 M434T3921 434.300018310547 434.300018310547 434.300018310547 3921.06695627639 3921.06695627639 3921.06695627639 1 1 0 2999 1.39185272534792 -8.02607978273467 0.0270249850534323
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4012 M434T3321 434.300018310547 434.300018310547 434.300018310547 3321.19223292142 3321.19223292142 3321.19223292142 1 0 1 1131 1.4106375443304 0.237481863062453 0.836508358405445
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4013 M434T3070 434.300018310547 434.300018310547 434.300018310547 3069.65367493135 3069.65367493135 3069.65367493135 1 0 1 2434 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4014 M434T3629 434.300018310547 434.300018310547 434.300018310547 3629.14687270421 3629.14687270421 3629.14687270421 1 0 1 1617 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4015 M434T3975 434.300018310547 434.300018310547 434.300018310547 3975.06650309073 3975.06650309073 3975.06650309073 1 1 0 2039 1.09288805876476 0.0627049120597251 0.955744053257876
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4016 M434T2733 434.399993896484 434.399993896484 434.399993896484 2732.76801834133 2732.76801834133 2732.76801834133 1 0 1 2497 4.56771073034343 0.763000830722376 0.575822474785995
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4017 M434T3695 434.5 434.5 434.5 3694.70989178009 3693.8323602065 3695.58742335368 2 1 1 600 1.78185866511126 -0.408979155242927 0.739886693549058
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4018 M434T3902 434.5 434.5 434.5 3902.32530367382 3902.32530367382 3902.32530367382 1 0 1 4837 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4019 M434T3590 434.5 434.5 434.5 3590.14954506394 3590.14954506394 3590.14954506394 1 1 0 1701 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4020 M435T3912 434.800018310547 434.800018310547 434.800018310547 3911.73383581848 3911.73383581848 3911.73383581848 1 0 1 4838 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4021 M435T3373 434.800018310547 434.800018310547 434.800018310547 3372.53060628831 3372.53060628831 3372.53060628831 1 1 0 1573 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4022 M435T2840 434.899993896484 434.899993896484 434.899993896484 2840.35022936475 2840.35022936475 2840.35022936475 1 0 1 4638 1.18965591929137 0.134651484358108 0.905216410007753
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4023 M435T2736 434.899993896484 434.899993896484 434.899993896484 2735.65452398377 2735.65452398377 2735.65452398377 1 1 0 2498 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4024 M435T3164 434.899993896484 434.899993896484 434.899993896484 3163.89837453896 3163.89837453896 3163.89837453896 1 0 1 836 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4025 M435T2590 434.899993896484 434.899993896484 434.899993896484 2589.76508488001 2589.76508488001 2589.76508488001 1 0 1 2897 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4026 M435T2944 435 435 435 2943.56454221243 2943.56454221243 2943.56454221243 1 0 1 2809 3.9731781232023 0.725680496759882 0.588989430124234
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4027 M435T3276 435 435 435 3275.5084930437 3275.5084930437 3275.5084930437 1 0 1 5020 2.35813266863415 0.530229806840251 0.669995740657682
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4028 M435T3731 435 435 435 3731.0908469449 3731.0908469449 3731.0908469449 1 0 1 3569 3.14430721047084 0.649889499292885 0.617769452761004
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4029 M435T3385 435 435 435 3384.8473164463 3384.8473164463 3384.8473164463 1 1 0 1574 3.74098050215839 -0.707837636380051 0.595503268259465
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4030 M435T3334 435 435 435 3333.87171065387 3333.87171065387 3333.87171065387 1 0 1 1080 2.19031301886965 0.68335363448977 0.608838617042178
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4031 M435T3966 435 435 435 3966.39877145841 3966.39877145841 3966.39877145841 1 0 1 2040 2.66283303949301 0.839739786771433 0.547060951151035
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4032 M435T4072 435.100006103516 435.100006103516 435.100006103516 4071.7068106046 4071.7068106046 4071.7068106046 1 1 0 3858 3.3530439539228 -1.63049449226086 0.34435933327905
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4033 M435T4173 435.100006103516 435.100006103516 435.100006103516 4172.93553468978 4172.93553468978 4172.93553468978 1 0 1 4398 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4034 M435T4109 435.399993896484 435.399993896484 435.399993896484 4109.47606512796 4109.47606512796 4109.47606512796 1 1 0 43 37.1089569908152 -1.39641169678476 0.39513551614469
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4035 M435T3340 435.399993896484 435.399993896484 435.399993896484 3340.17224928031 3340.17224928031 3340.17224928031 1 1 0 179 Inf -2.1768349652086 0.27414694036609
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4036 M435T3397 435.399993896484 435.399993896484 435.399993896484 3397.48157498888 3397.48157498888 3397.48157498888 1 1 0 490 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4037 M435T3922 435.399993896484 435.399993896484 435.399993896484 3922.2425435536 3922.2425435536 3922.2425435536 1 0 1 3000 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4038 M436T3757 435.5 435.5 435.5 3756.58693534667 3756.58693534667 3756.58693534667 1 1 0 995 Inf -1.33503417067136 0.409276044218921
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4039 M436T3963 435.5 435.5 435.5 3963.24477198361 3963.24477198361 3963.24477198361 1 0 1 2041 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4040 M436T2888 435.899993896484 435.899993896484 435.899993896484 2888.47938904019 2888.47938904019 2888.47938904019 1 1 0 3832 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4041 M436T2728 435.899993896484 435.899993896484 435.899993896484 2727.91346287142 2727.91346287142 2727.91346287142 1 1 0 2499 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4042 M436T2782 435.899993896484 435.899993896484 435.899993896484 2782.06165462036 2782.06165462036 2782.06165462036 1 0 1 4271 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4043 M436T4051 435.899993896484 435.899993896484 435.899993896484 4050.89620299928 4050.89620299928 4050.89620299928 1 0 1 3428 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4044 M436T4065 436 436 436 4064.86823339269 4064.86823339269 4064.86823339269 1 0 1 3894 1.02893770667414 0.0201681576424471 0.985741727934436
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4045 M436T4077 436 436 436 4076.75125511888 4076.75125511888 4076.75125511888 1 0 1 96 1.90988489591729 0.473905677025788 0.716952926200699
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4046 M436T3129 436 436 436 3128.97207747126 3128.97207747126 3128.97207747126 1 1 0 5317 2.45150888257176 -0.566347545663721 0.659609148480541
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4047 M436T3457 436 436 436 3457.15654781979 3457.15654781979 3457.15654781979 1 1 0 1278 5.01214287313708 -0.785012731946333 0.568315978757141
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4048 M436T3920 436 436 436 3919.5716518483 3919.5716518483 3919.5716518483 1 0 1 3001 11.4797657347604 0.909446237757975 0.528337325033335
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4049 M436T2768 436 436 436 2768.42988899288 2768.42988899288 2768.42988899288 1 1 0 3805 9.81344247868408 -2.63240254457188 0.197177432209002
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4050 M436T3994 436 436 436 3993.53112537303 3993.53112537303 3993.53112537303 1 1 0 4497 14.3072637389304 -0.927841824635311 0.522612514943322
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4051 M436T4139 436.100006103516 436.100006103516 436.100006103516 4139.40958781818 4139.40958781818 4139.40958781818 1 1 0 4233 1.5555971994884 -0.30043771220386 0.79642194618893
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4052 M436T2930 436.100006103516 436.100006103516 436.100006103516 2929.89446868652 2929.89446868652 2929.89446868652 1 1 0 3615 8.62350575368269 -1.06402439846284 0.474878964944527
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4053 M436T3627 436.200012207031 436.200012207031 436.200012207031 3627.07260038924 3626.42709947171 3629.14687270421 4 2 2 [75][M]- [M-H-COCH2]- 479.208 26 1.02545444456849 0.184510502262992 0.878689965206017
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4054 M436T3666 436.200012207031 436.200012207031 436.200012207031 3665.85204372625 3665.85204372625 3665.85204372625 1 1 0 [M+Cl+CF3COOH]- 267.233 2 3.40257656455677 -1.76777598500254 0.327681358447266
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4055 M436T2559 436.200012207031 436.200012207031 436.200012207031 2559.03497459635 2559.03497459635 2559.03497459635 1 1 0 65 2.60992907801434 -0.576014131517362 0.648944556412401
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4056 M436T2945 436.200012207031 436.200012207031 436.200012207031 2945.46102116048 2945.46102116048 2945.46102116048 1 1 0 70 1.77010543459963 -0.446671433239979 0.713218996817036
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4057 M436T2948 436.300018310547 436.300018310547 436.300018310547 2948.25720252818 2944.63769621478 2953.25944742478 3 2 1 [M-H-COCH2]- 479.31 70 1.09952139091893 0.118053860565322 0.921463042888717
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4058 M436T3657 436.300018310547 436.300018310547 436.300018310547 3656.55574542826 3656.55574542826 3656.55574542826 1 1 0 2406 20.0281410110851 -0.948888210460631 0.516063129158453
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4059 M436T2646 436.300018310547 436.300018310547 436.300018310547 2645.63553529159 2645.63553529159 2645.63553529159 1 0 1 5942 1.05764655828597 0.0396047462132771 0.972016175493089
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4060 M436T3726 436.300018310547 436.300018310547 436.300018310547 3726.36186918663 3726.36186918663 3726.36186918663 1 0 1 4679 Inf 2.70097147403319 0.225738051952817
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4061 M436T2845 436.399993896484 436.399993896484 436.399993896484 2845.06971747967 2845.06971747967 2845.06971747967 1 0 1 181 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4062 M436T3706 436.399993896484 436.399993896484 436.399993896484 3706.34494715838 3706.34494715838 3706.34494715838 1 1 0 1181 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4063 M436T3323 436.399993896484 436.399993896484 436.399993896484 3322.60925155928 3322.60925155928 3322.60925155928 1 1 0 1146 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4064 M436T4012 436.5 436.5 436.5 4012.17916555116 4010.80158041945 4013.55675068288 2 1 1 5224 1.55177993527513 -0.298892332961551 0.797381717932207
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4065 M437T2981 436.800018310547 436.800018310547 436.800018310547 2981.38883057329 2981.38883057329 2981.38883057329 1 1 0 4625 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4066 M437T2832 436.899993896484 436.899993896484 436.899993896484 2832.48567823725 2832.48567823725 2832.48567823725 1 0 1 121 1.3287147957617 0.197666810791167 0.862800955761919
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4067 M437T3878 436.899993896484 436.899993896484 436.899993896484 3878.30569854749 3878.30569854749 3878.30569854749 1 1 0 2746 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4068 M437T4214 436.899993896484 436.899993896484 436.899993896484 4213.60166691331 4213.60166691331 4213.60166691331 1 0 1 5322 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4069 M437T2991 436.899993896484 436.899993896484 436.899993896484 2990.77752733083 2990.77752733083 2990.77752733083 1 1 0 1838 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4070 M437T2954 436.899993896484 436.899993896484 436.899993896484 2954.42138689764 2954.42138689764 2954.42138689764 1 0 1 3189 6.88645649755403 0.845915189228305 0.548347094941861
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4071 M437T3227 437 437 437 3226.88937314348 3226.88937314348 3226.88937314348 1 1 0 5506 2.54719824817531 -0.565401164756025 0.65370255612724
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4072 M437T3282 437.100006103516 437.100006103516 437.100006103516 3281.77070074329 3277.00697689811 3286.53442458847 2 1 0 1222 1.55008560965169 -2.21492597526344 0.269799017971969
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4073 M437T3297 437.100006103516 437.100006103516 437.100006103516 3296.8379418699 3296.8379418699 3296.8379418699 1 0 1 2604 1.19121613580095 0.14977949416654 0.894787242975863
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4074 M437T3192 437.100006103516 437.100006103516 437.100006103516 3192.45048839551 3192.45048839551 3192.45048839551 1 0 1 [76][M]- 1743 1.28979905709514 -0.196146400585687 0.863239123462447
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4075 M437T3215 437.100006103516 437.100006103516 437.100006103516 3214.6396934876 3214.6396934876 3214.6396934876 1 1 0 [M-H]- 438.111 4280 1.38434565575025 -0.279244647228462 0.806434455196608
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4076 M437T3353 437.200012207031 437.200012207031 437.200012207031 3352.68016128321 3352.68016128321 3352.68016128321 1 1 0 705 4.90534429449063 -0.972162588557476 0.506570397204154
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4077 M437T3258 437.200012207031 437.200012207031 437.200012207031 3257.54450101158 3257.54450101158 3257.54450101158 1 1 0 3605 26.0927834482498 -0.960969755524054 0.51229403910796
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4078 M437T3658 437.200012207031 437.200012207031 437.200012207031 3658.10741726043 3658.10741726043 3658.10741726043 1 1 0 [M-H-COCH2]- 480.226 47 1.20967591677932 -0.474424567492154 0.706655360503469
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4079 M437T2788 437.200012207031 437.200012207031 437.200012207031 2788.46166349723 2788.46166349723 2788.46166349723 1 0 1 903 1.93371885089802 0.547856799028839 0.675992787596531
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4080 M437T2634 437.200012207031 437.200012207031 437.200012207031 2634.41938078827 2634.41938078827 2634.41938078827 1 1 0 2652 Inf -3.45280954060744 0.179467025198226
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4081 M437T3627 437.200012207031 437.200012207031 437.200012207031 3626.73281907078 3626.73281907078 3626.73281907078 1 0 1 [75][M+1]- 26 1.15607502174337 0.553286015835551 0.641887684295921
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4082 M437T3103 437.300018310547 437.300018310547 437.300018310547 3102.92452396684 3102.92452396684 3102.92452396684 1 0 1 3140 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4083 M437T4008 437.399993896484 437.399993896484 437.399993896484 4007.52522097639 4005.8187969675 4009.23164498528 2 1 1 5225 1.52500603955576 0.322921609448584 0.77898148130911
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4084 M437T3165 437.399993896484 437.399993896484 437.399993896484 3164.51054221883 3164.51054221883 3164.51054221883 1 1 0 837 4.1958957585117 -0.740920227656108 0.583541218798904
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4085 M437T3969 437.399993896484 437.399993896484 437.399993896484 3968.71192623715 3968.71192623715 3968.71192623715 1 1 0 2042 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4086 M437T3772 437.399993896484 437.399993896484 437.399993896484 3772.13186127025 3772.13186127025 3772.13186127025 1 0 1 939 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4087 M438T4047 437.5 437.5 437.5 4046.90183149477 4046.90183149477 4046.90183149477 1 1 0 4117 30.3057356980109 -0.966476936313858 0.510571868906674
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4088 M438T2793 437.899993896484 437.899993896484 437.899993896484 2793.16296782797 2793.16296782797 2793.16296782797 1 0 1 [M-H-COCH2]- 480.926 12 1.3133503178743 0.251310045220324 0.833343165634914
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4089 M438T3909 438 438 438 3908.5979499246 3908.5979499246 3908.5979499246 1 0 1 4839 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4090 M438T3172 438 438 438 3172.16099774074 3172.16099774074 3172.16099774074 1 0 1 779 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4091 M438T3111 438 438 438 3110.85179931934 3110.85179931934 3110.85179931934 1 0 1 5348 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4092 M438T2797 438 438 438 2797.03759266955 2797.03759266955 2797.03759266955 1 0 1 3941 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4093 M438T4182 438 438 438 4182.40649337683 4182.40649337683 4182.40649337683 1 0 1 6009 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4094 M438T3444 438.100006103516 438.100006103516 438.100006103516 3443.89112092707 3437.16778794794 3448.42769567721 4 2 2 [77][M]- [M-H]- 439.112 [M-H-CO]- 467.106 62 1.45985264383026 -0.702649854478525 0.577846462707548
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4095 M438T3461 438.100006103516 438.100006103516 438.100006103516 3460.97221817713 3460.97221817713 3460.97221817713 2 0 1 1254 1.16670378627645 -0.909447673308329 0.47667066480088
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4096 M438T3197 438.100006103516 438.100006103516 438.100006103516 3197.37151623259 3197.37151623259 3197.37151623259 1 1 0 [76][M+1]- 1757 8.67049787021514 -1.06256136069232 0.475401515437614
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4097 M438T3987 438.100006103516 438.100006103516 438.100006103516 3986.99967742483 3986.99967742483 3986.99967742483 1 0 1 4498 2.39214112978902 1.28249837110268 0.377340675748504
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4098 M438T4143 438.100006103516 438.100006103516 438.100006103516 4142.54286529035 4142.54286529035 4142.54286529035 1 1 0 4234 7.8925319099902 -0.866371525227403 0.541840866945965
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4099 M438T3454 438.200012207031 438.200012207031 438.200012207031 3453.96853558916 3448.36471818838 3457.56278898294 3 2 1 [78][M]- [M+Cl+CF3COOH]- 269.233 [M-H+CF3COOH]- 305.209 19 1.08557392766228 -0.182926439421983 0.884537012873786
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4100 M438T3210 438.200012207031 438.200012207031 438.200012207031 3209.92216100591 3209.92216100591 3209.92216100591 1 1 0 4281 1.77676856175596 -0.637320810601292 0.615783710163779
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4101 M438T4083 438.200012207031 438.200012207031 438.200012207031 4082.98442099473 4082.98442099473 4082.98442099473 1 1 0 200 12.7268589599179 -4.00141321020248 0.153617939926136
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4102 M438T4195 438.200012207031 438.200012207031 438.200012207031 4195.03695830995 4195.03695830995 4195.03695830995 1 0 1 6166 13.2865004517344 0.922127525659197 0.524389917018568
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4103 M438T4053 438.300018310547 438.300018310547 438.300018310547 4053.11228761297 4052.77255254373 4057.8849144412 3 2 1 77 11.0857782965181 -2.88148101082072 0.205230085788155
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4104 M438T3556 438.300018310547 438.300018310547 438.300018310547 3556.3895540966 3556.3895540966 3556.3895540966 1 0 1 5588 2.22711142404799 0.502643357661451 0.683349203549269
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4105 M438T3540 438.300018310547 438.300018310547 438.300018310547 3540.14981881787 3540.14981881787 3540.14981881787 1 0 1 1965 1.39978062118388 0.265972094164847 0.815459570485522
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4106 M438T3641 438.300018310547 438.300018310547 438.300018310547 3641.16551997803 3641.16551997803 3641.16551997803 1 1 0 [M-H-CH3]- 454.331 59 5.83947572077295 -0.816860685729759 0.557744610058281
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4107 M438T3062 438.300018310547 438.300018310547 438.300018310547 3061.76618286072 3061.76618286072 3061.76618286072 1 0 1 5412 Inf 1.64867767310961 0.347097418013256
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4108 M438T2839 438.300018310547 438.300018310547 438.300018310547 2838.54623144569 2838.54623144569 2838.54623144569 1 1 0 125 1.89462834629223 -0.469912054935538 0.719148174204021
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4109 M438T3885 438.399993896484 438.399993896484 438.399993896484 3884.62918444727 3884.62918444727 3884.62918444727 1 1 0 2245 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4110 M438T4180 438.399993896484 438.399993896484 438.399993896484 4180.27602614419 4180.27602614419 4180.27602614419 1 1 0 6010 8.12337505789353 -0.870328776440141 0.5405907377122
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4111 M438T2967 438.399993896484 438.399993896484 438.399993896484 2967.31573455006 2967.31573455006 2967.31573455006 1 1 0 3261 2.75580105747185 -0.633193929803168 0.638554023439391
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4112 M438T3991 438.399993896484 438.399993896484 438.399993896484 3990.95261859624 3990.95261859624 3990.95261859624 1 1 0 4499 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4113 M438T2977 438.5 438.5 438.5 2976.69697715884 2976.69697715884 2976.69697715884 1 1 0 5283 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4114 M438T4135 438.5 438.5 438.5 4134.65820643842 4134.65820643842 4134.65820643842 1 0 1 3981 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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4131 M439T3455 439.200012207031 439.200012207031 439.200012207031 3454.63966387319 3450.78005277903 3454.73998523726 3 1 2 [78][M+1]- 1260 1.59001495544341 2.42565282174518 0.136941194329729
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lecorguille
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4132 M439T4072 439.200012207031 439.200012207031 439.200012207031 4071.7068106046 4071.7068106046 4071.7068106046 2 1 0 96 3.74125547746296 -1.63194508991082 0.335712781371557
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lecorguille
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4133 M439T4058 439.300018310547 439.300018310547 439.300018310547 4057.8849144412 4052.77255254373 4060.2122408209 3 2 1 129 15.4571985850941 -3.1989832148563 0.191110202324358
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lecorguille
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4134 M439T3922 439.300018310547 439.300018310547 439.300018310547 3921.53465901455 3921.53465901455 3921.53465901455 1 1 0 2966 1.47294075169149 -0.350924258777786 0.785099006274481
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lecorguille
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4135 M439T2821 439.300018310547 439.300018310547 439.300018310547 2820.9693756722 2820.9693756722 2820.9693756722 1 1 0 3299 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4136 M439T3129 439.399993896484 439.399993896484 439.399993896484 3128.94073315599 3128.94073315599 3128.94073315599 1 0 1 163 Inf 1 0.5
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lecorguille
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4137 M440T4021 439.5 439.5 439.5 4021.34774437821 4021.34774437821 4021.34774437821 1 0 1 5578 Inf 1 0.5
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lecorguille
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lecorguille
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4139 M440T2654 440 440 440 2653.58420853695 2653.58420853695 2653.58420853695 1 0 1 5844 1.30083390245342 0.612015502108748 0.635823397251058
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4142 M440T3459 440.100006103516 440.100006103516 440.100006103516 3458.75015890217 3458.75015890217 3458.75015890217 1 1 0 [M+Cl]- 405.129 [M-H]- 441.106 19 3.33235415861345 -2.75577984481793 0.111434957928285
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4143 M440T3481 440.200012207031 440.200012207031 440.200012207031 3480.97342114389 3480.97342114389 3480.97342114389 1 1 0 [M+Cl]- 405.229 [M-H]- 441.206 [M-H-CO]- 469.208 31 1.03457590111628 -0.330667480305338 0.795710414193817
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4144 M440T2853 440.200012207031 440.200012207031 440.200012207031 2852.77211751114 2852.77211751114 2852.77211751114 1 1 0 111 1.28009684703965 0.457906159676275 0.6938831235991
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4145 M440T3444 440.200012207031 440.200012207031 440.200012207031 3444.40447306028 3444.40447306028 3444.40447306028 1 1 0 [M-H+CF3COOH]- 307.225 62 1.23277160160494 1.87430475248909 0.28107505309289
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4146 M440T3467 440.200012207031 440.200012207031 440.200012207031 3466.85812724904 3466.85812724904 3466.85812724904 1 1 0 66 1.31547385203674 1.04154629821396 0.416036995561067
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4147 M440T4201 440.200012207031 440.200012207031 440.200012207031 4200.69027150176 4200.69027150176 4200.69027150176 1 1 0 198 60.6801549759612 -11.5811051523683 0.0460438797063478
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4149 M440T3097 440.300018310547 440.300018310547 440.300018310547 3097.4935938957 3097.4935938957 3097.4935938957 1 1 0 5356 1.0424210027919 -0.0293668256897583 0.979243065627066
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4150 M440T2899 440.300018310547 440.300018310547 440.300018310547 2898.92238702059 2898.92238702059 2898.92238702059 1 1 0 134 1.04868610174788 0.0532859065733918 0.962412471736225
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4151 M440T2774 440.300018310547 440.300018310547 440.300018310547 2774.18368393945 2774.18368393945 2774.18368393945 1 1 0 5133 1.85855174261365 -0.461396272778789 0.724505413326432
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4152 M440T2722 440.300018310547 440.300018310547 440.300018310547 2722.17781757098 2722.17781757098 2722.17781757098 1 0 1 2462 8.25936698306079 4.09791378326889 0.0671315006924955
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lecorguille
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4153 M440T4045 440.399993896484 440.399993896484 440.399993896484 4045.33253925044 4045.33253925044 4045.33253925044 1 1 0 106 2.66487297561513 -0.584920846406033 0.645007244098815
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lecorguille
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4154 M440T2638 440.399993896484 440.399993896484 440.399993896484 2638.05009525096 2638.05009525096 2638.05009525096 1 1 0 2653 7.03064812630035 -0.849218504320731 0.547291003694638
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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4156 M441T3976 440.600006103516 440.600006103516 440.600006103516 3975.85959815996 3975.85959815996 3975.85959815996 1 0 1 2043 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4157 M441T3393 440.899993896484 440.899993896484 440.899993896484 3392.55402399013 3392.55402399013 3392.55402399013 1 1 0 491 Inf -1 0.5
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lecorguille
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4158 M441T4127 441 441 441 4127.03660592508 4125.3114579078 4128.76175394237 2 1 1 [2M-2H+K]- 202.025 23 1.92498619104417 0.426411634134734 0.722899894871019
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4159 M441T3165 441 441 441 3164.51054221883 3164.51054221883 3164.51054221883 1 1 0 10 Inf -1 0.5
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lecorguille
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4160 M441T2791 441 441 441 2791.02377756377 2791.02377756377 2791.02377756377 1 0 1 915 Inf 1 0.5
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lecorguille
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4161 M441T4111 441.100006103516 441.100006103516 441.100006103516 4111.42132545829 4111.42132545829 4111.42132545829 1 0 1 [M-H-CH4]- 458.131 43 1.4400021125746 0.346732802538816 0.767963283692813
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lecorguille
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4162 M441T4127 441.100006103516 441.100006103516 441.100006103516 4126.89956529202 4126.89956529202 4126.89956529202 1 0 1 23 1.27441771480859 0.29173308772659 0.800853766370943
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
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4163 M441T3037 441.200012207031 441.200012207031 441.200012207031 3036.66497408795 3036.66497408795 3036.66497408795 1 0 1 71 1.28963982822736 0.301485131879752 0.795067355074589
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4164 M441T2749 441.200012207031 441.200012207031 441.200012207031 2748.99251369626 2748.99251369626 2748.99251369626 1 1 0 4356 3.2949434237889 -0.687477489566127 0.611845627080683
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lecorguille
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4165 M441T3658 441.200012207031 441.200012207031 441.200012207031 3658.10741726043 3658.10741726043 3658.10741726043 1 1 0 [M-H-CH3]- 457.231 47 3.27728161245059 -0.804531591830284 0.568565298958479
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lecorguille
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4166 M441T3481 441.300018310547 441.300018310547 441.300018310547 3480.97342114389 3480.97342114389 3480.97342114389 1 1 0 1796 2.12999521147905 0.523832534686455 0.689355138338744
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4167 M441T4145 441.300018310547 441.300018310547 441.300018310547 4144.53058058354 4144.53058058354 4144.53058058354 1 0 1 5834 3.30401587478278 0.667437690091619 0.610837053654852
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4168 M441T3672 441.300018310547 441.300018310547 441.300018310547 3672.00891284854 3672.00891284854 3672.00891284854 1 1 0 [M-H-C2H4]- 470.336 2 1.47891299978326 0.303949272557773 0.79424479523713
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lecorguille
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4169 M441T2729 441.300018310547 441.300018310547 441.300018310547 2729.46044270343 2729.46044270343 2729.46044270343 1 1 0 2500 Inf -2.22768191650234 0.268613050498844
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4170 M441T3843 441.300018310547 441.300018310547 441.300018310547 3843.40060985387 3843.40060985387 3843.40060985387 1 0 1 1391 4.94503657082885 2.17176953806158 0.181397965050162
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lecorguille
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4171 M441T3892 441.399993896484 441.399993896484 441.399993896484 3892.28021041121 3892.28021041121 3892.28021041121 1 0 1 4904 Inf 1 0.5
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4172 M441T2728 441.399993896484 441.399993896484 441.399993896484 2728.06725194668 2728.06725194668 2728.06725194668 1 0 1 2501 Inf 1 0.5
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lecorguille
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4173 M441T4052 441.399993896484 441.399993896484 441.399993896484 4051.60950608857 4051.60950608857 4051.60950608857 1 1 0 3429 Inf -1 0.5
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lecorguille
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4174 M442T3749 441.600006103516 441.600006103516 441.600006103516 3748.6565373502 3748.6565373502 3748.6565373502 1 1 0 1063 Inf -1 0.5
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lecorguille
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4175 M442T3755 441.700012207031 441.700012207031 441.700012207031 3754.99866028928 3754.99866028928 3754.99866028928 1 1 0 1064 Inf -1 0.5
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4176 M442T3927 441.899993896484 441.899993896484 441.899993896484 3927.40977769388 3927.40977769388 3927.40977769388 1 0 1 3002 Inf 1 0.5
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lecorguille
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diff changeset
4177 M442T2763 441.899993896484 441.899993896484 441.899993896484 2762.88865689156 2762.88865689156 2762.88865689156 1 0 1 3806 Inf 1 0.5
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lecorguille
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diff changeset
4178 M442T2693 442 442 442 2693.45219033324 2692.34676200243 2694.55761866405 2 1 1 5706 1.07997675691627 0.0743534759277895 0.950462224040823
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lecorguille
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4179 M442T4119 442 442 442 4119.10736445651 4114.57375713629 4123.64097177674 2 1 1 4563 1.89518402833329 0.444495013200427 0.721199375901626
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4180 M442T4045 442 442 442 4044.86584644462 4044.86584644462 4044.86584644462 1 1 0 4118 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4181 M442T3337 442 442 442 3337.06159167431 3337.06159167431 3337.06159167431 1 0 1 1113 Inf 1 0.5
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lecorguille
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diff changeset
4182 M442T3862 442 442 442 3862.32067754438 3862.32067754438 3862.32067754438 1 0 1 [M-H-C3H2O3]- 529.007 21 2.57786229014041 -0.57064987920684 0.651340382197696
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lecorguille
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diff changeset
4183 M442T4067 442 442 442 4066.97814594478 4066.97814594478 4066.97814594478 1 1 0 3895 23.3441832226331 -1.20045266982989 0.441288001998296
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4184 M442T3453 442.100006103516 442.100006103516 442.100006103516 3452.86917989958 3452.86917989958 3452.86917989958 1 1 0 [M-H]- 443.11 74 Inf -1 0.5
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lecorguille
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diff changeset
4185 M442T3668 442.100006103516 442.100006103516 442.100006103516 3668.25871952049 3668.25871952049 3668.25871952049 1 1 0 2 Inf -2.27481118322665 0.263668255431076
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lecorguille
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diff changeset
4186 M442T4117 442.100006103516 442.100006103516 442.100006103516 4117.34393140744 4117.34393140744 4117.34393140744 1 1 0 120 1.60351207489157 -0.436716336264792 0.708983796138531
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lecorguille
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diff changeset
4187 M442T3622 442.200012207031 442.200012207031 442.200012207031 3622.2021883723 3622.2021883723 3622.2021883723 1 0 1 1598 4.54926031417692 0.981243815684206 0.503472918930262
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4188 M442T2632 442.200012207031 442.200012207031 442.200012207031 2631.63156617644 2631.63156617644 2631.63156617644 1 1 0 2654 12.6914878300003 -1.58948902475186 0.350945072258035
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lecorguille
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diff changeset
4189 M442T2517 442.300018310547 442.300018310547 442.300018310547 2516.927668269 2516.927668269 2516.927668269 1 0 1 5053 Inf 3.35434630234687 0.184448965167665
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4190 M442T3520 442.300018310547 442.300018310547 442.300018310547 3519.71194161723 3519.71194161723 3519.71194161723 1 1 0 408 3.23571160614674 -0.87137728860102 0.5436646612629
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4191 M442T3631 442.300018310547 442.300018310547 442.300018310547 3631.25754203364 3631.25754203364 3631.25754203364 1 0 1 2363 13.622934809498 0.924107998145625 0.523773856798616
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4192 M442T3091 442.399993896484 442.399993896484 442.399993896484 3091.14193860861 3091.14193860861 3091.14193860861 1 0 1 5356 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4193 M442T3380 442.399993896484 442.399993896484 442.399993896484 3380.22886443151 3380.22886443151 3380.22886443151 1 1 0 1576 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4194 M442T3910 442.5 442.5 442.5 3909.96477831024 3909.96477831024 3909.96477831024 1 1 0 4785 Inf -2.24528872764412 0.266745472053828
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4195 M443T2658 442.899993896484 442.899993896484 442.899993896484 2657.9347285802 2655.90981797773 2659.95963918267 2 0 2 103 1.5772102453354 21.2244491989581 0.00648516283432388
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4196 M443T2684 442.899993896484 442.899993896484 442.899993896484 2684.41623929172 2684.41623929172 2684.41623929172 1 1 0 6 1.81828578521041 -1.02578044400289 0.430701262457731
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4197 M443T4141 442.899993896484 442.899993896484 442.899993896484 4140.96996477634 4140.96996477634 4140.96996477634 1 1 0 4235 Inf -2.26394146453451 0.264793430446574
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4198 M443T2593 442.899993896484 442.899993896484 442.899993896484 2593.46397459635 2593.46397459635 2593.46397459635 1 1 0 [79][M]- 2879 1.70490699281876 -0.765429159689507 0.580857100149919
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4199 M443T3159 443 443 443 3158.51557850104 3158.51557850104 3158.51557850104 1 1 0 838 Inf -1 0.5
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lecorguille
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diff changeset
4200 M443T2635 443.100006103516 443.100006103516 443.100006103516 2634.84105363384 2634.84105363384 2634.84105363384 1 1 0 2628 3.19288730190295 -1.91872942600331 0.305049554266933
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4201 M443T3219 443.100006103516 443.100006103516 443.100006103516 3219.43934347283 3219.43934347283 3219.43934347283 1 0 1 4325 1.17165671517883 0.571660460094111 0.664754850976711
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4202 M443T2544 443.200012207031 443.200012207031 443.200012207031 2543.67828676082 2543.67828676082 2543.67828676082 1 1 0 5162 2.13944426057137 -0.803687502183854 0.505919429733428
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4203 M443T3442 443.200012207031 443.200012207031 443.200012207031 3441.94593941496 3441.94593941496 3441.94593941496 1 0 1 2929 16.9361062206737 4.26212265542782 0.121165835925162
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4204 M443T3042 443.200012207031 443.200012207031 443.200012207031 3042.4230943222 3042.4230943222 3042.4230943222 1 1 0 3224 3.12620847099983 -2.77484670463017 0.177873123362262
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4205 M443T3256 443.300018310547 443.300018310547 443.300018310547 3255.91054716351 3255.91054716351 3255.91054716351 1 0 1 1920 1.68646655792073 0.350120970266863 0.766278762768257
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4206 M443T3523 443.300018310547 443.300018310547 443.300018310547 3522.90390220282 3522.90390220282 3522.90390220282 1 0 1 409 1.21122799136314 0.676389982597909 0.568550920344193
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4207 M443T3054 443.300018310547 443.300018310547 443.300018310547 3054.47122440718 3054.47122440718 3054.47122440718 1 1 0 3494 Inf -6.15034365869175 0.102611688174436
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4208 M443T4135 443.300018310547 443.300018310547 443.300018310547 4134.71155413718 4134.71155413718 4134.71155413718 1 1 0 99 1.45638507127629 -0.288375751681793 0.811040839184692
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4209 M443T3619 443.300018310547 443.300018310547 443.300018310547 3619.17469804149 3619.17469804149 3619.17469804149 1 0 1 2588 25.0058236085062 1.60080104568486 0.353879705772282
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4210 M443T4081 443.399993896484 443.399993896484 443.399993896484 4081.15581527027 4081.15581527027 4081.15581527027 1 1 0 200 Inf -1.95290762099168 0.301278150067887
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4211 M443T3946 443.399993896484 443.399993896484 443.399993896484 3946.4687733971 3946.4687733971 3946.4687733971 1 1 0 3739 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4212 M444T3703 443.5 443.5 443.5 3703.22405105961 3703.22405105961 3703.22405105961 1 1 0 1182 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4213 M444T2720 443.899993896484 443.899993896484 443.899993896484 2720.18669043818 2720.18669043818 2720.18669043818 1 1 0 2502 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4214 M444T2606 443.899993896484 443.899993896484 443.899993896484 2605.98397459635 2605.98397459635 2605.98397459635 1 1 0 4014 1.2847613675263 0.257608330270711 0.839404843985433
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4215 M444T2586 443.899993896484 443.899993896484 443.899993896484 2585.93228676082 2585.93228676082 2585.93228676082 1 1 0 [79][M+1]- 61 1.55525910492724 -0.399903625943566 0.727942959104624
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4216 M444T2703 444 444 444 2702.78795054871 2700.25221255246 2705.32368854496 2 0 2 136 2.45482961381055 0.954991825767478 0.473556219112962
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4217 M444T2662 444 444 444 2661.5564698857 2661.5564698857 2661.5564698857 1 0 1 42 1.13501464935145 -0.281395291442365 0.821974527598564
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4218 M444T2854 444 444 444 2854.33877468858 2854.33877468858 2854.33877468858 1 1 0 111 5.41728070758788 -2.27686100769437 0.177678849592767
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4219 M444T2683 444 444 444 2682.82633158321 2682.82633158321 2682.82633158321 1 1 0 [M-H+NaCOOH]- 377.03 6 2.31916515436894 -0.732383098541266 0.579996316454268
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lecorguille
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4220 M444T4138 444 444 444 4137.82080373509 4137.82080373509 4137.82080373509 1 1 0 3982 3.76485203659935 -0.709774297193052 0.594788941432595
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4221 M444T2684 444.100006103516 444.100006103516 444.100006103516 2683.62713632746 2682.82780937765 2684.06586984756 3 1 2 [M+Cl+HCOOH]- 363.113 6 1.31862477724237 0.396513247513732 0.758799690932016
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4222 M444T3761 444.100006103516 444.100006103516 444.100006103516 3761.22387996072 3761.22387996072 3761.22387996072 1 0 1 950 17.3382386013334 0.940760584382122 0.518593823320977
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4223 M444T2896 444.200012207031 444.200012207031 444.200012207031 2895.76079638847 2890.66347406525 2896.36275941013 3 2 1 95 1.56732686890076 0.463127254975978 0.720606160268548
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4224 M444T2722 444.200012207031 444.200012207031 444.200012207031 2721.6897701577 2721.6897701577 2721.6897701577 1 0 1 2453 1.72972904716074 0.516527688608476 0.676592787587162
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lecorguille
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4225 M444T2638 444.200012207031 444.200012207031 444.200012207031 2638.49610464103 2638.49610464103 2638.49610464103 1 0 1 2633 1.14720452470378 0.181292595813018 0.885818214486244
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4226 M444T3753 444.200012207031 444.200012207031 444.200012207031 3753.41135813072 3753.41135813072 3753.41135813072 1 1 0 [M-2H+Na]- 423.212 [M-H]- 445.205 14 1.06245518158369 -0.0544508961958232 0.961541632233634
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4227 M444T2882 444.300018310547 444.300018310547 444.300018310547 2881.52679761665 2881.52679761665 2881.52679761665 1 1 0 4735 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4228 M444T3888 444.300018310547 444.300018310547 444.300018310547 3887.79268385776 3887.79268385776 3887.79268385776 1 1 0 2246 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4229 M444T3856 444.300018310547 444.300018310547 444.300018310547 3856.21608781489 3856.21608781489 3856.21608781489 1 1 0 1392 Inf -3.8790551192137 0.160620012901298
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4230 M444T3744 444.300018310547 444.300018310547 444.300018310547 3743.91030943196 3743.91030943196 3743.91030943196 1 1 0 1065 11.0568368092556 -1.03141878314476 0.490128196385109
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4231 M444T4040 444.300018310547 444.300018310547 444.300018310547 4040.0202308036 4040.0202308036 4040.0202308036 1 0 1 5309 Inf 2.52564520491815 0.240005735881521
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lecorguille
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4232 M444T2994 444.300018310547 444.300018310547 444.300018310547 2994.28256299347 2994.28256299347 2994.28256299347 1 1 0 1839 4.24298348875172 -0.743934491273898 0.582475626190176
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4233 M444T3739 444.399993896484 444.399993896484 444.399993896484 3739.17432644358 3739.17432644358 3739.17432644358 1 1 0 4715 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4234 M444T3202 444.399993896484 444.399993896484 444.399993896484 3201.82102320952 3201.82102320952 3201.82102320952 1 0 1 1758 Inf 1 0.5
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lecorguille
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4235 M444T3362 444.5 444.5 444.5 3361.70776945878 3355.52662774881 3367.88891116876 2 1 1 4660 1.33522324592488 0.200951606220675 0.860607388295691
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lecorguille
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4236 M445T3178 444.899993896484 444.899993896484 444.899993896484 3177.71358108993 3175.46440827929 3179.96275390057 2 1 1 781 1.01862262825018 0.0130461495972783 0.990775728700793
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4237 M445T3101 444.899993896484 444.899993896484 444.899993896484 3100.64956031064 3100.64956031064 3100.64956031064 1 1 0 3125 4.66172877255606 -0.768015650233835 0.574096533317663
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4238 M445T3680 444.899993896484 444.899993896484 444.899993896484 3680.31219147978 3680.31219147978 3680.31219147978 1 1 0 3693 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4239 M445T3723 444.899993896484 444.899993896484 444.899993896484 3723.2119601311 3723.2119601311 3723.2119601311 1 0 1 3447 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4240 M445T4143 444.899993896484 444.899993896484 444.899993896484 4142.9532295589 4142.9532295589 4142.9532295589 1 0 1 4236 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4241 M445T2927 444.899993896484 444.899993896484 444.899993896484 2926.78638974879 2926.78638974879 2926.78638974879 1 1 0 [M-H]- 445.911 60 5.20873676887131 -0.793523242186628 0.565459634267603
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4242 M445T2684 445 445 445 2684.06586984756 2684.06586984756 2684.06586984756 1 0 1 6 1.32356452253862 1.1552251828052 0.409346184317751
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4243 M445T3776 445 445 445 3775.71351917101 3775.71351917101 3775.71351917101 1 1 0 5854 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4244 M445T3607 445 445 445 3607.00779131237 3607.00779131237 3607.00779131237 1 0 1 4672 4.08850935737414 1.23094654753347 0.389353057639121
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4245 M445T4117 445.100006103516 445.100006103516 445.100006103516 4117.34393140744 4117.34393140744 4117.34393140744 1 1 0 120 1.57957888382138 -1.33331654010888 0.386385538283602
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4246 M445T3791 445.100006103516 445.100006103516 445.100006103516 3790.84576766149 3790.84576766149 3790.84576766149 1 0 1 117 2.00779002310608 3.23926154793378 0.160764716330724
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4247 M445T3939 445.100006103516 445.100006103516 445.100006103516 3938.52736193678 3938.52736193678 3938.52736193678 1 1 0 4174 3.78259783003978 -1.26715120327884 0.367784861496288
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4248 M445T4053 445.200012207031 445.200012207031 445.200012207031 4053.11228761297 4052.77255254373 4058.65996267593 3 1 2 77 1.01998959065311 0.0245519242830219 0.984345295735426
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lecorguille
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4249 M445T2528 445.200012207031 445.200012207031 445.200012207031 2527.882668269 2527.882668269 2527.882668269 1 0 1 5598 1.70129870129872 0.562708694904503 0.634362383455492
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4250 M445T2898 445.200012207031 445.200012207031 445.200012207031 2897.94212950607 2897.94212950607 2897.94212950607 1 1 0 4777 1.07893071167823 -0.131104314192188 0.911239592747245
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4251 M445T3206 445.200012207031 445.200012207031 445.200012207031 3205.61174474925 3205.61174474925 3205.61174474925 1 1 0 4326 2.8541037432218 -0.613084889398671 0.632885399167297
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4252 M445T3827 445.200012207031 445.200012207031 445.200012207031 3826.85876452323 3826.85876452323 3826.85876452323 1 0 1 33 4.09265625035669 1.3490091045731 0.367940647826793
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4253 M445T4220 445.200012207031 445.200012207031 445.200012207031 4219.78742796746 4219.78742796746 4219.78742796746 1 0 1 164 7.33095520623841 0.855668065135469 0.545235361951066
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4254 M445T3764 445.300018310547 445.300018310547 445.300018310547 3763.5671268248 3763.5671268248 3763.5671268248 1 1 0 996 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4255 M445T4173 445.300018310547 445.300018310547 445.300018310547 4172.93553468978 4172.93553468978 4172.93553468978 1 0 1 4399 7.42299480329787 0.85753695106237 0.544641191681264
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4256 M445T3341 445.300018310547 445.300018310547 445.300018310547 3341.47361287755 3341.47361287755 3341.47361287755 1 1 0 5511 4.39654325988411 -0.75330840340559 0.57918616990399
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4257 M445T2567 445.300018310547 445.300018310547 445.300018310547 2567.15228676082 2567.15228676082 2567.15228676082 1 1 0 5861 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4258 M446T3530 445.700012207031 445.700012207031 445.700012207031 3529.86368185261 3529.86368185261 3529.86368185261 1 0 1 1966 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4259 M446T3000 445.700012207031 445.700012207031 445.700012207031 3000.47592797306 3000.47592797306 3000.47592797306 1 1 0 1840 6.49576942386311 -0.836202885327895 0.551465850539411
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4260 M446T2718 445.800018310547 445.800018310547 445.800018310547 2717.74648766991 2717.74648766991 2717.74648766991 1 1 0 2503 2.98812869829981 -0.630948103224962 0.62544893905417
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4261 M446T2792 445.800018310547 445.800018310547 445.800018310547 2791.5834804339 2791.5834804339 2791.5834804339 1 0 1 12 2.85415962393984 0.705873991523832 0.583271530347591
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4262 M446T2623 445.800018310547 445.800018310547 445.800018310547 2623.25470730788 2623.25470730788 2623.25470730788 1 1 0 2655 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4263 M446T3345 445.899993896484 445.899993896484 445.899993896484 3344.60570447021 3344.60570447021 3344.60570447021 1 1 0 811 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4264 M446T3295 445.899993896484 445.899993896484 445.899993896484 3295.29181043493 3295.29181043493 3295.29181043493 1 0 1 2605 Inf 1.43965936590822 0.38649091365382
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4265 M446T3046 445.899993896484 445.899993896484 445.899993896484 3045.55609609406 3045.55609609406 3045.55609609406 1 1 0 4950 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4266 M446T2755 445.899993896484 445.899993896484 445.899993896484 2755.29238586212 2755.29238586212 2755.29238586212 1 1 0 5823 6.5311653263857 -0.83713224359099 0.551166500008392
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4267 M446T4200 445.899993896484 445.899993896484 445.899993896484 4199.77346853085 4199.77346853085 4199.77346853085 1 0 1 5700 4.3187578601181 0.748644850573687 0.580818125834266
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4268 M446T3423 445.899993896484 445.899993896484 445.899993896484 3423.42619145082 3423.42619145082 3423.42619145082 1 0 1 875 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4269 M446T2940 446 446 446 2940.44116306851 2940.44116306851 2940.44116306851 1 0 1 2811 11.3347986365361 0.908248309178366 0.528710571178125
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4270 M446T3936 446 446 446 3935.54239794017 3935.54239794017 3935.54239794017 1 1 0 107 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4271 M446T3518 446 446 446 3518.13556032481 3518.13556032481 3518.13556032481 1 1 0 410 Inf -1 0.5
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lecorguille
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4272 M446T3911 446 446 446 3910.64900627845 3910.64900627845 3910.64900627845 1 1 0 4786 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4273 M446T3857 446.100006103516 446.100006103516 446.100006103516 3856.78184598162 3856.78184598162 3856.78184598162 1 0 1 1393 Inf 1.52046452242516 0.370362991048521
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4274 M446T2893 446.200012207031 446.200012207031 446.200012207031 2892.58722465327 2892.58722465327 2892.58722465327 1 1 0 95 1.3324096950629 0.352000106060842 0.772309196514819
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4275 M446T2625 446.200012207031 446.200012207031 446.200012207031 2624.84877465702 2624.84877465702 2624.84877465702 1 1 0 2656 1.18621200671507 -0.148658435623976 0.896360507247055
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4276 M446T3490 446.200012207031 446.200012207031 446.200012207031 3490.33071116467 3490.33071116467 3490.33071116467 1 0 1 1797 1.30675965362342 0.400549567084319 0.739481319982543
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4277 M446T4103 446.300018310547 446.300018310547 446.300018310547 4102.71068161173 4100.23294003354 4105.18842318993 2 1 1 5812 1.55356398499366 0.299615301694333 0.796932551308041
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4278 M446T3277 446.300018310547 446.300018310547 446.300018310547 3276.55852937273 3276.55852937273 3276.55852937273 1 0 1 1244 2.14963680755738 -1.1482653964379 0.455429519007893
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4279 M446T3298 446.300018310547 446.300018310547 446.300018310547 3298.38383878001 3298.38383878001 3298.38383878001 1 0 1 2594 Inf 16.4841665632645 0.0385728048097222
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lecorguille
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4280 M446T2887 446.300018310547 446.300018310547 446.300018310547 2886.97775847116 2886.97775847116 2886.97775847116 1 0 1 5661 1.39232982031919 0.228866584297459 0.842140878064177
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4281 M446T3642 446.399993896484 446.399993896484 446.399993896484 3641.87121406634 3641.87121406634 3641.87121406634 1 0 1 1540 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4282 M446T4174 446.399993896484 446.399993896484 446.399993896484 4173.99308562184 4173.99308562184 4173.99308562184 1 1 0 4400 Inf -1.23838581156921 0.432455239116688
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4283 M447T2682 446.800018310547 446.800018310547 446.800018310547 2682.4546014594 2682.4546014594 2682.4546014594 1 0 1 656 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4284 M447T2949 446.899993896484 446.899993896484 446.899993896484 2948.57935029677 2948.57935029677 2948.57935029677 1 1 0 [M-H-CH4]- 463.933 70 1.15677283485378 0.115547898186094 0.918636469125483
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lecorguille
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4285 M447T4144 446.899993896484 446.899993896484 446.899993896484 4143.9632134336 4143.9632134336 4143.9632134336 1 0 1 5839 2.89443545534011 0.800254998514227 0.535765905250237
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4286 M447T3169 446.899993896484 446.899993896484 446.899993896484 3169.04072732697 3169.04072732697 3169.04072732697 1 0 1 782 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4287 M447T3448 447 447 447 3448.42769567721 3448.42769567721 3448.42769567721 1 0 1 2930 Inf 1 0.5
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lecorguille
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4288 M447T3461 447 447 447 3460.67099542738 3460.67099542738 3460.67099542738 1 1 0 1279 Inf -1 0.5
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lecorguille
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4289 M447T4124 447 447 447 4123.74438860043 4123.74438860043 4123.74438860043 1 1 0 1731 Inf -1 0.5
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lecorguille
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4290 M447T3524 447 447 447 3523.52977420091 3523.52977420091 3523.52977420091 1 1 0 411 1.70821093438078 -0.391042817233767 0.752150198116655
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lecorguille
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4291 M447T3581 447 447 447 3580.63962475463 3580.63962475463 3580.63962475463 1 1 0 1628 2.58562916572992 -0.571960686188401 0.650753230614918
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lecorguille
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4292 M447T4119 447.100006103516 447.100006103516 447.100006103516 4119.30268860621 4119.30268860621 4119.30268860621 1 0 1 120 1.12906438272609 -0.137323097004194 0.904707610850102
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4293 M447T3416 447.100006103516 447.100006103516 447.100006103516 3415.87715861582 3415.87715861582 3415.87715861582 1 1 0 854 2.39568784386013 -0.657351573566331 0.607449770718516
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lecorguille
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4294 M447T3868 447.200012207031 447.200012207031 447.200012207031 3867.85439645128 3852.86036818393 3874.075633099 4 2 2 [80][M]- [M+Cl]- 412.231 21 1.00942632062878 0.0123452280578478 0.991277364541715
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4295 M447T3093 447.200012207031 447.200012207031 447.200012207031 3092.7094432471 3092.7094432471 3092.7094432471 1 0 1 5368 5.23483106430043 4.2173240888148 0.145092975383368
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lecorguille
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4296 M447T2662 447.200012207031 447.200012207031 447.200012207031 2661.50315527364 2661.50315527364 2661.50315527364 1 1 0 42 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4297 M447T3019 447.200012207031 447.200012207031 447.200012207031 3018.94357186587 3018.94357186587 3018.94357186587 1 1 0 2148 Inf -2.15807505782001 0.276243002161726
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lecorguille
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4298 M447T4097 447.300018310547 447.300018310547 447.300018310547 4097.23784360811 4097.23784360811 4097.23784360811 1 0 1 5103 16.2912704403849 0.936854143663033 0.519809311239803
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lecorguille
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4299 M447T3291 447.300018310547 447.300018310547 447.300018310547 3291.02454723973 3291.02454723973 3291.02454723973 1 1 0 2114 Inf -1 0.5
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lecorguille
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diff changeset
4300 M447T2654 447.300018310547 447.300018310547 447.300018310547 2654.32755137323 2654.32755137323 2654.32755137323 1 0 1 5845 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4301 M447T4066 447.300018310547 447.300018310547 447.300018310547 4066.41996987292 4066.41996987292 4066.41996987292 1 0 1 3896 5.6011159379038 0.808676939062575 0.56043144953482
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4302 M447T2627 447.300018310547 447.300018310547 447.300018310547 2626.81716666296 2626.81716666296 2626.81716666296 1 1 0 2657 4.93089450138037 -0.781292035708412 0.56957250281142
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4303 M447T3931 447.300018310547 447.300018310547 447.300018310547 3930.54499932366 3930.54499932366 3930.54499932366 1 0 1 2942 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4304 M447T3544 447.399993896484 447.399993896484 447.399993896484 3543.60312635477 3543.60312635477 3543.60312635477 1 1 0 2349 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4305 M448T4149 447.700012207031 447.700012207031 447.700012207031 4148.61566113482 4148.61566113482 4148.61566113482 1 0 1 5618 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4306 M448T2853 447.899993896484 447.899993896484 447.899993896484 2852.77211751114 2852.77211751114 2852.77211751114 1 1 0 4262 4.79445889676352 -0.77475318230313 0.571792622847063
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4307 M448T2559 447.899993896484 447.899993896484 447.899993896484 2559.32728676082 2559.32728676082 2559.32728676082 1 1 0 3077 Inf -1.4882536658023 0.376647522800739
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4308 M448T3362 447.899993896484 447.899993896484 447.899993896484 3361.727738288 3361.727738288 3361.727738288 1 1 0 4661 2.4162450662993 -0.541584508670638 0.664646652824703
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4309 M448T2734 447.899993896484 447.899993896484 447.899993896484 2734.10499524488 2734.10499524488 2734.10499524488 1 1 0 2463 1.70655960194959 -0.357215415777985 0.762091899619062
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4310 M448T3705 448 448 448 3705.00880068764 3705.00880068764 3705.00880068764 1 0 1 1165 Inf 1.45605398636621 0.383120017505125
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4311 M448T3462 448 448 448 3462.21813542294 3462.21813542294 3462.21813542294 1 1 0 1257 2.60259201680457 -0.615312258704735 0.648593801477914
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4312 M448T3631 448 448 448 3631.25754203364 3631.25754203364 3631.25754203364 1 0 1 2364 2.08113295468861 0.468241719025259 0.70071645741159
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4313 M448T2546 448 448 448 2545.94708488001 2545.94708488001 2545.94708488001 1 0 1 5152 1.2776600254345 0.278695725302886 0.826712575622203
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4314 M448T3547 448.100006103516 448.100006103516 448.100006103516 3546.98944553125 3541.9990379483 3547.24521550954 3 2 1 2325 2.77974993519944 -1.05114729762346 0.415205344084876
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4315 M448T3015 448.100006103516 448.100006103516 448.100006103516 3014.9139246582 3014.9139246582 3014.9139246582 1 0 1 [M-2H+Na]- 427.112 37 1.00041053707867 -0.00244009151890384 0.998302417907823
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4316 M448T3403 448.100006103516 448.100006103516 448.100006103516 3403.38646124844 3403.38646124844 3403.38646124844 1 1 0 1305 1.06011322803684 0.0538342072191299 0.963326888667132
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4317 M448T3868 448.200012207031 448.200012207031 448.200012207031 3867.85439645128 3851.28370176813 3874.075633099 4 2 2 [80][M+1]- 21 1.03310965358529 -0.0435139479271487 0.969245787240617
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4318 M448T3502 448.200012207031 448.200012207031 448.200012207031 3502.11662938801 3502.11662938801 3502.11662938801 1 0 1 [81][M]- [M-H-COCH2]- 491.21 76 20.5973437418975 1.00781543411408 0.497518647572337
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4319 M448T2787 448.200012207031 448.200012207031 448.200012207031 2786.70925520093 2786.70925520093 2786.70925520093 1 1 0 916 5.12004329873822 -1.47113681784412 0.339018005322009
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4320 M448T3924 448.300018310547 448.300018310547 448.300018310547 3924.24053454928 3924.24053454928 3924.24053454928 1 1 0 3003 3.12476107218329 -0.647620516228118 0.618678455225207
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4321 M448T3249 448.300018310547 448.300018310547 448.300018310547 3248.80362625011 3248.80362625011 3248.80362625011 1 0 1 1921 5.75262684150172 0.813959729493243 0.558694849981148
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4322 M448T3942 448.300018310547 448.300018310547 448.300018310547 3941.77857116674 3941.77857116674 3941.77857116674 1 1 0 4128 1.44828792564509 -0.273667850916935 0.816926470591564
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4323 M448T4039 448.300018310547 448.300018310547 448.300018310547 4038.53517276696 4038.53517276696 4038.53517276696 1 1 0 92 2.76006263603739 -0.599551157039584 0.63864870677059
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4324 M448T3791 448.300018310547 448.300018310547 448.300018310547 3791.23922865522 3791.23922865522 3791.23922865522 1 0 1 4456 Inf 4.16222658367249 0.150106694639379
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4325 M448T2805 448.399993896484 448.399993896484 448.399993896484 2804.56537064767 2804.56537064767 2804.56537064767 1 0 1 5186 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4326 M448T2739 448.399993896484 448.399993896484 448.399993896484 2738.75585067703 2738.75585067703 2738.75585067703 1 1 0 116 9.54147384831412 -0.890318020037342 0.534309391985659
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4327 M448T2982 448.399993896484 448.399993896484 448.399993896484 2982.31729290754 2982.31729290754 2982.31729290754 1 0 1 4630 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4328 M449T2875 448.899993896484 448.899993896484 448.899993896484 2875.23742094063 2875.23742094063 2875.23742094063 1 1 0 4736 2.20478227232469 -0.497645755772465 0.6858228516376
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4329 M449T2574 448.899993896484 448.899993896484 448.899993896484 2574.11608488001 2574.11608488001 2574.11608488001 1 0 1 4086 1.48936228985862 0.272787196430785 0.813784883578413
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4330 M449T3408 448.899993896484 448.899993896484 448.899993896484 3408.05384664472 3408.05384664472 3408.05384664472 1 1 0 2548 1.78611253966389 -1.03468403273598 0.410022252354685
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4331 M449T4141 449 449 449 4140.96054937085 4136.24529906271 4145.67579967899 2 2 0 4237 3.15808738485512 -1.98774830848804 0.243206216458233
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4332 M449T2991 449 449 449 2990.9007583049 2990.9007583049 2990.9007583049 1 0 1 1825 13.2962177781868 0.922186171209637 0.524371673331996
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4333 M449T3974 449 449 449 3974.28264461918 3974.28264461918 3974.28264461918 1 0 1 2044 8.48436012804614 0.876071907443662 0.538780652036257
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4334 M449T3550 449 449 449 3549.57444136163 3549.57444136163 3549.57444136163 1 0 1 2350 4.90285399405466 0.795526900181319 0.571910938898906
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4335 M449T2891 449.100006103516 449.100006103516 449.100006103516 2890.84142450705 2889.09562436083 2892.58722465327 2 1 1 95 1.36772681317202 0.365702963834946 0.776802201647912
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4336 M449T3985 449.100006103516 449.100006103516 449.100006103516 3984.59888720794 3984.59888720794 3984.59888720794 1 1 0 4482 1.21816635252578 0.215040039620753 0.863638455786297
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4337 M449T3607 449.100006103516 449.100006103516 449.100006103516 3607.44118916071 3607.44118916071 3607.44118916071 1 1 0 4675 1.79177588415253 -0.515317900391066 0.683040547056535
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4338 M449T3501 449.200012207031 449.200012207031 449.200012207031 3500.58472682777 3500.58472682777 3500.58472682777 1 0 1 [81][M+1]- 76 19.8476342912247 0.955411360585042 0.514511838601896
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4339 M449T2654 449.200012207031 449.200012207031 449.200012207031 2653.55225737212 2653.55225737212 2653.55225737212 1 1 0 5840 1.99118026709488 -0.723643664762076 0.588451167471404
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4340 M449T3286 449.200012207031 449.200012207031 449.200012207031 3286.26441641646 3286.26441641646 3286.26441641646 1 1 0 93 8.06676625321799 -28.2829482417624 0.00175731629113418
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4341 M449T3549 449.300018310547 449.300018310547 449.300018310547 3548.83214501254 3548.83214501254 3548.83214501254 1 1 0 44 18.4540574334561 -9.37555661726674 0.0184733647032358
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4342 M449T3279 449.300018310547 449.300018310547 449.300018310547 3278.66099664615 3278.66099664615 3278.66099664615 1 0 1 18 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4343 M449T3619 449.300018310547 449.300018310547 449.300018310547 3618.62698531311 3618.62698531311 3618.62698531311 1 1 0 2562 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4344 M449T3394 449.300018310547 449.300018310547 449.300018310547 3394.04760467768 3394.04760467768 3394.04760467768 1 0 1 492 1.28805930199625 -0.176650484588277 0.876930454029893
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4345 M449T3593 449.300018310547 449.300018310547 449.300018310547 3593.36455864082 3593.36455864082 3593.36455864082 1 1 0 5886 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4346 M449T3689 449.399993896484 449.399993896484 449.399993896484 3689.13267357975 3689.13267357975 3689.13267357975 1 1 0 601 7.55377632984201 -0.860111653731607 0.543823671396291
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4347 M449T4078 449.399993896484 449.399993896484 449.399993896484 4078.00675277229 4078.00675277229 4078.00675277229 1 1 0 96 8.49467866772681 -0.876228667955559 0.538731311483109
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4348 M450T3542 449.5 449.5 449.5 3541.9990379483 3541.9990379483 3541.9990379483 1 1 0 2351 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4349 M450T2788 449.700012207031 449.700012207031 449.700012207031 2788.46166349723 2788.46166349723 2788.46166349723 1 0 1 896 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4350 M450T2931 449.899993896484 449.899993896484 449.899993896484 2931.11055668219 2931.11055668219 2931.11055668219 1 0 1 3629 1.09287461634635 0.0703964230475387 0.950330562738875
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4351 M450T3090 450 450 450 3090.23847085274 3090.23847085274 3090.23847085274 1 0 1 5369 1.75941850025273 0.42259380419499 0.740965474709779
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4352 M450T3409 450 450 450 3408.75234343553 3408.75234343553 3408.75234343553 1 0 1 2549 1.29531985500113 0.221678843699928 0.858161413845273
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4353 M450T3560 450 450 450 3559.53243724798 3559.53243724798 3559.53243724798 1 0 1 1675 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4354 M450T3805 450 450 450 3805.49627473024 3805.49627473024 3805.49627473024 1 0 1 4183 2.61445342745754 0.576760961812473 0.648612465957171
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4355 M450T3883 450 450 450 3883.04786546855 3883.04786546855 3883.04786546855 1 1 0 2247 1.60488938901653 -0.319887488174 0.784454392035715
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4356 M450T3593 450 450 450 3593.36455864082 3593.36455864082 3593.36455864082 1 1 0 5887 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4357 M450T2569 450 450 450 2569.42108488001 2569.42108488001 2569.42108488001 1 0 1 5296 7.15426497277682 0.851941076601401 0.546422253286706
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4358 M450T3842 450.100006103516 450.100006103516 450.100006103516 3841.52198953037 3841.52198953037 3841.52198953037 1 1 0 21 1.66534958213216 -0.394171339246012 0.748780148985879
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4359 M450T3629 450.200012207031 450.200012207031 450.200012207031 3629.14687270421 3627.98198184035 3631.25754203364 3 1 2 [M-H-CO]- 479.208 [M-H-COCH2]- 493.213 26 1.43267926686213 0.733513744889568 0.579143831158009
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4360 M450T2886 450.200012207031 450.200012207031 450.200012207031 2886.11873245211 2882.81762362955 2889.41984127468 2 1 1 194 2.4958489254919 -0.643556834808712 0.607412362955963
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4361 M450T2905 450.200012207031 450.200012207031 450.200012207031 2904.73772040417 2904.73772040417 2904.73772040417 1 0 1 3918 4.78981584277798 0.774523943600233 0.571870735639413
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4364 M450T3944 450.399993896484 450.399993896484 450.399993896484 3943.81418042124 3941.16625793116 3946.46210291131 2 1 1 4154 1.93113482056256 0.428168759036847 0.721944735127107
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4365 M450T3248 450.399993896484 450.399993896484 450.399993896484 3247.92956471655 3247.92956471655 3247.92956471655 1 1 0 1922 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4366 M450T4205 450.399993896484 450.399993896484 450.399993896484 4204.5099086314 4204.5099086314 4204.5099086314 1 0 1 4932 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4367 M450T4138 450.399993896484 450.399993896484 450.399993896484 4137.84320879208 4137.84320879208 4137.84320879208 1 1 0 3983 1.92066779279693 -0.425171813828914 0.723575071371454
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lecorguille
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4368 M451T2535 450.800018310547 450.800018310547 450.800018310547 2534.99208488001 2534.99208488001 2534.99208488001 1 0 1 5782 1.89603024574672 0.46710843872165 0.718991632867595
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4369 M451T3102 450.899993896484 450.899993896484 450.899993896484 3102.12726595357 3102.12726595357 3102.12726595357 1 0 1 3141 Inf 1 0.5
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lecorguille
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4370 M451T3568 450.899993896484 450.899993896484 450.899993896484 3567.90711566462 3567.90711566462 3567.90711566462 1 1 0 1641 Inf -1 0.5
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lecorguille
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4371 M451T3834 450.899993896484 450.899993896484 450.899993896484 3834.20284641246 3834.20284641246 3834.20284641246 1 1 0 3355 Inf -1 0.5
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lecorguille
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lecorguille
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lecorguille
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4374 M451T3820 451 451 451 3819.73488646232 3819.73488646232 3819.73488646232 1 0 1 1857 4.01542475734061 0.72870290809781 0.587900691915772
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lecorguille
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4375 M451T3706 451.100006103516 451.100006103516 451.100006103516 3705.93273745051 3705.93273745051 3705.93273745051 1 0 1 1183 2.19659824714783 0.544680785371884 0.682448411450992
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lecorguille
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4376 M451T3619 451.100006103516 451.100006103516 451.100006103516 3618.62698531311 3618.62698531311 3618.62698531311 1 1 0 2564 5.79778139119415 -3.05530224805874 0.118683688614269
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lecorguille
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4377 M451T3636 451.100006103516 451.100006103516 451.100006103516 3635.52159472652 3635.52159472652 3635.52159472652 1 0 1 2845 5.59378360829863 0.80841380285326 0.560518162214002
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lecorguille
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4378 M451T3746 451.100006103516 451.100006103516 451.100006103516 3746.37862980992 3746.37862980992 3746.37862980992 1 1 0 14 3.31257222814115 -5.03721029214632 0.123791417583831
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lecorguille
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4379 M451T2533 451.200012207031 451.200012207031 451.200012207031 2533.42708488001 2533.42708488001 2533.42708488001 1 0 1 5889 1.02203791469195 0.0211139066090729 0.98635100691075
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4380 M451T2935 451.200012207031 451.200012207031 451.200012207031 2934.56017221744 2934.56017221744 2934.56017221744 1 1 0 [M-H-H20]- 470.211 57 14.2287842226868 -1.17227771561868 0.448011604150106
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lecorguille
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4381 M451T2905 451.300018310547 451.300018310547 451.300018310547 2904.72065631416 2904.72065631416 2904.72065631416 1 0 1 3920 Inf 1 0.5
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lecorguille
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4382 M451T2544 451.300018310547 451.300018310547 451.300018310547 2544.38208488001 2544.38208488001 2544.38208488001 1 0 1 5163 Inf 1 0.5
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lecorguille
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4383 M451T2842 451.300018310547 451.300018310547 451.300018310547 2841.72429271997 2841.72429271997 2841.72429271997 1 1 0 252 1.18803998558691 0.221159681653904 0.84824749040907
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4384 M451T3793 451.300018310547 451.300018310547 451.300018310547 3793.37767615419 3793.37767615419 3793.37767615419 1 1 0 5520 1.56807080210897 -0.361710336218289 0.778758369585051
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lecorguille
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4385 M451T2671 451.300018310547 451.300018310547 451.300018310547 2671.16873376101 2671.16873376101 2671.16873376101 1 0 1 4049 Inf 1 0.5
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lecorguille
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4386 M451T4082 451.399993896484 451.399993896484 451.399993896484 4081.67960673404 4078.32713411482 4085.03207935327 2 0 2 5725 Inf 3.35589467716426 0.184368542596315
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lecorguille
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4387 M451T3937 451.399993896484 451.399993896484 451.399993896484 3937.10064224346 3937.10064224346 3937.10064224346 1 1 0 [M-H-COCH2]- 494.426 107 6.25184520976448 -1.29817402652324 0.398807529676562
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4388 M451T3730 451.399993896484 451.399993896484 451.399993896484 3729.51399364127 3729.51399364127 3729.51399364127 1 0 1 3570 2.21222545011768 0.499321756083994 0.684991418715682
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4389 M451T3186 451.399993896484 451.399993896484 451.399993896484 3185.96106903426 3185.96106903426 3185.96106903426 1 1 0 2176 8.15234442393674 -0.870809052601088 0.540439180353443
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4390 M452T2794 451.700012207031 451.700012207031 451.700012207031 2794.0260569043 2794.0260569043 2794.0260569043 1 0 1 917 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4391 M452T3964 451.800018310547 451.800018310547 451.800018310547 3963.94513514887 3963.94513514887 3963.94513514887 1 1 0 2045 Inf -1 0.5
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lecorguille
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4392 M452T2851 451.800018310547 451.800018310547 451.800018310547 2851.20225492459 2851.20225492459 2851.20225492459 1 1 0 6070 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4393 M452T2685 451.899993896484 451.899993896484 451.899993896484 2685.19535222698 2685.19535222698 2685.19535222698 1 1 0 657 Inf -1 0.5
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lecorguille
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4394 M452T2529 451.899993896484 451.899993896484 451.899993896484 2529.447668269 2529.447668269 2529.447668269 1 0 1 5599 1.55085599194358 -0.298517419847464 0.797614755107858
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4395 M452T3466 452 452 452 3465.60554756889 3465.60554756889 3465.60554756889 1 0 1 4030 Inf 1 0.5
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lecorguille
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4396 M452T3437 452 452 452 3437.02976871333 3437.02976871333 3437.02976871333 1 1 0 4891 Inf -1 0.5
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lecorguille
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4397 M452T2953 452 452 452 2952.96860923202 2952.96860923202 2952.96860923202 1 0 1 3191 1.32228992367025 -0.23487119889236 0.836239843822439
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4398 M452T3383 452 452 452 3383.32875490952 3383.32875490952 3383.32875490952 1 0 1 1577 Inf 2.36644650043713 0.254529786554928
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lecorguille
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4399 M452T3275 452 452 452 3274.99853643994 3274.99853643994 3274.99853643994 1 0 1 [M+Cl]- 417.033 145 4.90669545190722 2.00094140777302 0.211346365491577
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lecorguille
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4400 M452T2973 452 452 452 2973.4744364714 2973.4744364714 2973.4744364714 1 0 1 5916 4.4308514792302 1.32450632897975 0.36713563814097
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lecorguille
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4401 M452T3070 452.100006103516 452.100006103516 452.100006103516 3070.16523320869 3066.7789362783 3072.37676096677 4 2 2 [M-H]- 453.112 48 1.2261289268465 2.56268192310785 0.227334793408675
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lecorguille
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4402 M452T3980 452.100006103516 452.100006103516 452.100006103516 3979.83290448422 3979.83290448422 3979.83290448422 1 1 0 1994 1.02142246331393 -0.0276764418940853 0.98043354701593
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lecorguille
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4403 M452T2546 452.100006103516 452.100006103516 452.100006103516 2545.94708488001 2545.94708488001 2545.94708488001 1 0 1 153 1.19507404211955 0.271610325301118 0.812904083676954
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lecorguille
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4404 M452T3230 452.200012207031 452.200012207031 452.200012207031 3229.95422042188 3229.95422042188 3229.95422042188 1 1 0 2697 1.31186669848051 0.285466041115626 0.812345767586097
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lecorguille
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4405 M452T2542 452.200012207031 452.200012207031 452.200012207031 2541.966668269 2541.966668269 2541.966668269 1 0 1 5547 1.18625246399 -0.285232184309048 0.820665443473125
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lecorguille
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4406 M452T3185 452.300018310547 452.300018310547 452.300018310547 3184.64481211908 3184.64481211908 3184.64481211908 1 0 1 2166 2.82454798077525 0.608924942403322 0.634644904741613
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lecorguille
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4407 M452T2573 452.300018310547 452.300018310547 452.300018310547 2573.11997459635 2573.11997459635 2573.11997459635 1 1 0 257 3.3531306043215 -0.672501888322227 0.608868022949022
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lecorguille
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4408 M452T2791 452.300018310547 452.300018310547 452.300018310547 2791.02377756377 2791.02377756377 2791.02377756377 1 0 1 918 2.22811922754624 0.502866786991881 0.683239004771988
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4409 M452T2554 452.300018310547 452.300018310547 452.300018310547 2554.486668269 2554.486668269 2554.486668269 1 0 1 65 Inf 2.7284096009433 0.223650962996295
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lecorguille
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4410 M452T3158 452.300018310547 452.300018310547 452.300018310547 3158.24545876284 3158.24545876284 3158.24545876284 1 1 0 820 Inf -1 0.5
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lecorguille
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4411 M452T2918 452.300018310547 452.300018310547 452.300018310547 2918.39175940831 2918.39175940831 2918.39175940831 1 1 0 2772 Inf -4.57604112496497 0.136967002119627
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lecorguille
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4412 M452T2804 452.399993896484 452.399993896484 452.399993896484 2803.78419580111 2803.78419580111 2803.78419580111 1 1 0 5187 Inf -1 0.5
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lecorguille
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4413 M452T3913 452.5 452.5 452.5 3913.13591534322 3913.13591534322 3913.13591534322 1 1 0 5143 Inf -1 0.5
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lecorguille
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4414 M453T3534 452.899993896484 452.899993896484 452.899993896484 3533.99907546819 3533.99907546819 3533.99907546819 1 1 0 1967 Inf -1 0.5
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4415 M453T4247 453 453 453 4246.95315089905 4246.95315089905 4246.95315089905 1 0 1 6230 Inf 1 0.5
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4416 M453T2536 453.100006103516 453.100006103516 453.100006103516 2535.707668269 2535.707668269 2535.707668269 1 0 1 5783 Inf 1 0.5
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4417 M453T3745 453.100006103516 453.100006103516 453.100006103516 3745.49127859189 3745.49127859189 3745.49127859189 1 1 0 [M-H]- 454.112 14 5.48173812824865 -0.804302651842282 0.561875612967774
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4418 M453T4179 453.100006103516 453.100006103516 453.100006103516 4178.70541800153 4178.70541800153 4178.70541800153 1 1 0 4401 3.16475658565188 -0.652233843713673 0.616833334652071
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4419 M453T4059 453.100006103516 453.100006103516 453.100006103516 4059.09018753112 4059.09018753112 4059.09018753112 1 1 0 4702 87.6923462479967 -1.17504466990788 0.448820768026394
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4420 M453T3066 453.200012207031 453.200012207031 453.200012207031 3065.68923445994 3065.24043569815 3066.13803322174 2 1 1 48 1.35110760964492 -0.282924389676896 0.80699303989656
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4421 M453T2865 453.200012207031 453.200012207031 453.200012207031 2865.20185051505 2865.20185051505 2865.20185051505 1 1 0 [M-H-CO]- 482.206 87 1.03546457363778 0.029646927886255 0.979043040135855
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4422 M453T2508 453.200012207031 453.200012207031 453.200012207031 2507.68428676082 2507.68428676082 2507.68428676082 1 1 0 102 20.157387984607 -1.10479982344476 0.467376059682673
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4423 M453T2723 453.200012207031 453.200012207031 453.200012207031 2723.27653495129 2723.27653495129 2723.27653495129 1 1 0 2454 1.03035552147664 0.0237993819716886 0.983175028878303
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lecorguille
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4424 M453T2907 453.200012207031 453.200012207031 453.200012207031 2907.4141560597 2907.4141560597 2907.4141560597 1 1 0 97 1.0271563048751 -0.0209964592132076 0.985181763527794
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lecorguille
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4425 M453T3283 453.200012207031 453.200012207031 453.200012207031 3283.39199261657 3283.39199261657 3283.39199261657 1 0 1 1221 1.01580497510936 -0.0117234159860173 0.991713184307279
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4426 M453T2577 453.200012207031 453.200012207031 453.200012207031 2576.54228676082 2576.54228676082 2576.54228676082 1 1 0 104 1.02066681610469 0.0160106110673971 0.98868281019744
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4427 M453T2965 453.200012207031 453.200012207031 453.200012207031 2964.8199675924 2964.8199675924 2964.8199675924 1 1 0 3243 1.21810520549483 -0.16069050599543 0.887817453961721
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4428 M453T2628 453.200012207031 453.200012207031 453.200012207031 2628.42193807791 2628.42193807791 2628.42193807791 1 1 0 2630 1.00616944075474 -0.00495431286084126 0.996499837645001
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4429 M453T2609 453.200012207031 453.200012207031 453.200012207031 2609.40628676082 2609.40628676082 2609.40628676082 1 1 0 4026 1.03766909390477 -0.0295660564592719 0.979098225774591
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4430 M453T2818 453.200012207031 453.200012207031 453.200012207031 2817.76537812102 2817.76537812102 2817.76537812102 1 1 0 3319 1.0596761984957 0.0450305237191259 0.968175834423813
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4431 M453T2739 453.200012207031 453.200012207031 453.200012207031 2738.75585067703 2738.75585067703 2738.75585067703 1 1 0 116 1.06788713214186 -0.0541286759361648 0.961754219764018
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lecorguille
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4432 M453T3022 453.200012207031 453.200012207031 453.200012207031 3022.11927913362 3022.11927913362 3022.11927913362 1 1 0 2119 1.25690727910846 -0.185024479393037 0.872207969409624
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4433 M453T2839 453.200012207031 453.200012207031 453.200012207031 2838.54623144569 2838.54623144569 2838.54623144569 1 1 0 125 1.02479612794709 0.0191144403758764 0.986494582282053
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4434 M453T3331 453.200012207031 453.200012207031 453.200012207031 3330.68854637728 3330.68854637728 3330.68854637728 1 0 1 15 1.03232182475564 0.0236427988708232 0.983285605047641
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4435 M453T3371 453.200012207031 453.200012207031 453.200012207031 3370.57986821671 3370.57986821671 3370.57986821671 1 0 1 [M-H-H20]- 472.228 25 1.02856928399497 0.0218954773684701 0.984558194183214
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lecorguille
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4436 M453T2765 453.200012207031 453.200012207031 453.200012207031 2765.28357059722 2765.28357059722 2765.28357059722 1 1 0 94 1.08594743821428 0.0639880507623017 0.954806556879016
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lecorguille
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4437 M453T2558 453.200012207031 453.200012207031 453.200012207031 2557.76228676082 2557.76228676082 2557.76228676082 1 1 0 3059 1.0071457553817 -0.00569275331362791 0.995976446750445
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4438 M453T4414 453.300018310547 453.300018310547 453.300018310547 4413.62422276304 4413.62422276304 4413.62422276304 1 1 0 273 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4439 M453T4476 453.399993896484 453.399993896484 453.399993896484 4476.22322276304 4476.22322276304 4476.22322276304 1 1 0 6205 Inf -1 0.5
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lecorguille
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4440 M454T3968 453.899993896484 453.899993896484 453.899993896484 3968.18438167274 3968.18438167274 3968.18438167274 1 0 1 1983 1.29709851005133 0.181398411069794 0.873724461682938
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lecorguille
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4441 M454T4167 453.899993896484 453.899993896484 453.899993896484 4166.6216435323 4166.6216435323 4166.6216435323 1 0 1 5927 5.01758873198792 0.785257701912005 0.568233417900464
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4442 M454T4163 454 454 454 4162.99467843184 4162.99467843184 4162.99467843184 1 1 0 270 5.10753474183508 -1.0521961673486 0.466253590342699
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lecorguille
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4443 M454T3281 454.100006103516 454.100006103516 454.100006103516 3280.75119501694 3278.31156790231 3286.53442458847 4 2 2 [82][M]- 18 1.14417795409686 -0.337282485374677 0.782665251355041
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4444 M454T2771 454.100006103516 454.100006103516 454.100006103516 2771.04042670827 2771.04042670827 2771.04042670827 1 1 0 5131 5.37303957164 0.87665836211946 0.532474026813916
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4445 M454T3289 454.200012207031 454.200012207031 454.200012207031 3289.10475211434 3289.10475211434 3289.10475211434 1 0 1 2098 9.66423733204531 1.33190450474353 0.406649345281221
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4446 M454T3261 454.200012207031 454.200012207031 454.200012207031 3260.74570744212 3260.74570744212 3260.74570744212 1 1 0 3606 7.04366739069987 -0.867594641059592 0.540286281045994
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4447 M454T4281 454.200012207031 454.200012207031 454.200012207031 4281.38215089905 4281.38215089905 4281.38215089905 1 0 1 278 Inf 2.14398734177205 0.277836867840162
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4448 M454T3909 454.300018310547 454.300018310547 454.300018310547 3908.5979499246 3908.5979499246 3908.5979499246 1 0 1 4840 3.6345962924177 0.886510210333334 0.512860717413626
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4449 M454T3677 454.300018310547 454.300018310547 454.300018310547 3676.69409965901 3676.69409965901 3676.69409965901 1 0 1 89 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4450 M454T3844 454.300018310547 454.300018310547 454.300018310547 3844.18597732081 3844.18597732081 3844.18597732081 1 0 1 1394 4.17109479373643 0.739304827883386 0.584113891493584
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4451 M454T3971 454.399993896484 454.399993896484 454.399993896484 3971.32398789918 3971.32398789918 3971.32398789918 1 0 1 1989 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4452 M454T4379 454.5 454.5 454.5 4379.30674443202 4379.30674443202 4379.30674443202 1 0 1 334 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4453 M455T2551 454.899993896484 454.899993896484 454.899993896484 2551.356668269 2551.356668269 2551.356668269 1 0 1 3078 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4454 M455T4343 455 455 455 4343.31274443202 4343.31274443202 4343.31274443202 1 0 1 6107 Inf 1 0.5
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lecorguille
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4455 M455T3054 455 455 455 3054.47122440718 3054.47122440718 3054.47122440718 1 1 0 3495 Inf -1 0.5
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lecorguille
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4456 M455T2793 455 455 455 2793.16296782797 2793.16296782797 2793.16296782797 1 0 1 899 Inf 1 0.5
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lecorguille
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4457 M455T4059 455 455 455 4059.09018753112 4059.09018753112 4059.09018753112 1 1 0 4706 37.4598072887282 -0.972958099512218 0.508540917645214
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4458 M455T3283 455.100006103516 455.100006103516 455.100006103516 3283.39199261657 3279.90396347494 3284.9460296969 3 2 1 [82][M+1]- 1227 1.11063458650795 -0.68558492432127 0.583930059992779
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4459 M455T2736 455.100006103516 455.100006103516 455.100006103516 2736.14070977722 2736.14070977722 2736.14070977722 1 0 1 4600 2.22486114972642 0.561463593746861 0.6637539579495
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4460 M455T3265 455.200012207031 455.200012207031 455.200012207031 3264.94468136521 3264.34773765568 3265.54162507473 2 2 0 85 5.61018496962516 -1.97282371714598 0.266384074394303
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4461 M455T3093 455.200012207031 455.200012207031 455.200012207031 3093.4088629907 3093.4088629907 3093.4088629907 1 0 1 5356 Inf 3.98901919195847 0.156370537641324
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4462 M455T4116 455.200012207031 455.200012207031 455.200012207031 4115.90921963138 4115.90921963138 4115.90921963138 1 1 0 43 1.0283388669478 -0.0280309262340085 0.98201215962087
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4463 M455T2649 455.300018310547 455.300018310547 455.300018310547 2648.81282919735 2648.81282919735 2648.81282919735 1 0 1 5679 1.45738918360284 0.258780497255117 0.822728695884659
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4464 M455T2821 455.300018310547 455.300018310547 455.300018310547 2821.48052115151 2821.48052115151 2821.48052115151 1 0 1 3288 2.94476604678339 0.655063028343775 0.62797021023281
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4465 M455T3937 455.399993896484 455.399993896484 455.399993896484 3936.93935391593 3936.93935391593 3936.93935391593 1 1 0 4155 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4466 M455T4172 455.399993896484 455.399993896484 455.399993896484 4171.84658519174 4171.84658519174 4171.84658519174 1 0 1 4402 8.39035194094827 0.87462538915944 0.539236107461556
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4467 M456T2858 455.899993896484 455.899993896484 455.899993896484 2858.03173805314 2858.03173805314 2858.03173805314 1 1 0 4263 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4468 M456T2933 456 456 456 2933.01639058469 2933.01639058469 2933.01639058469 1 0 1 3617 5.8662551606088 0.817737335018497 0.557457915239183
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lecorguille
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4469 M456T3110 456 456 456 3109.99201166669 3109.99201166669 3109.99201166669 1 0 1 5349 1.12176627638756 -0.159545983802798 0.89921153185977
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lecorguille
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4470 M456T2753 456 456 456 2753.10959343937 2753.10959343937 2753.10959343937 1 0 1 114 2.13677957201014 0.510993286872498 0.689157475337569
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lecorguille
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4471 M456T2959 456 456 456 2959.05537348542 2959.05537348542 2959.05537348542 1 0 1 3263 1.16974363874059 0.142351200891571 0.908673872753652
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4472 M456T3601 456 456 456 3601.30450043454 3601.30450043454 3601.30450043454 1 1 0 1455 Inf -1 0.5
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lecorguille
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4473 M456T3943 456 456 456 3942.74331488216 3942.74331488216 3942.74331488216 1 0 1 4156 Inf 4.16979070427707 0.149844351547018
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lecorguille
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4474 M456T2787 456 456 456 2786.90521866559 2786.90521866559 2786.90521866559 1 0 1 904 Inf 1.60135458788622 0.35537328114067
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lecorguille
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4475 M456T3276 456.100006103516 456.100006103516 456.100006103516 3275.84163155748 3272.3599491931 3283.35616198684 4 2 2 [82][M+2]- 1217 2.12887632986729 -5.69328066983944 0.0528628579126833
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lecorguille
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4476 M456T4075 456.100006103516 456.100006103516 456.100006103516 4075.14194222414 4075.14194222414 4075.14194222414 1 1 0 3897 1.24559258070087 0.168011118601648 0.882083830010453
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4477 M456T4138 456.100006103516 456.100006103516 456.100006103516 4137.82080373509 4137.82080373509 4137.82080373509 1 1 0 99 27.7834496660585 -0.963383533565042 0.511539586352065
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4478 M456T3285 456.200012207031 456.200012207031 456.200012207031 3285.44543186531 3280.23894841582 3290.65191531481 2 0 2 [83][M]- 1229 2.54947858940892 1.51779222078669 0.348992239178672
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lecorguille
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4479 M456T3752 456.300018310547 456.300018310547 456.300018310547 3752.13537413021 3751.05903920425 3753.21170905618 2 1 1 1033 1.19631874510493 -0.146388329616834 0.897186932872004
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lecorguille
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4480 M456T3520 456.300018310547 456.300018310547 456.300018310547 3520.38334302036 3520.38334302036 3520.38334302036 1 1 0 412 Inf -1 0.5
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lecorguille
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4481 M456T3536 456.300018310547 456.300018310547 456.300018310547 3535.59605392345 3535.59605392345 3535.59605392345 1 1 0 35 1.20536176846831 0.131123320996376 0.908038477659923
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lecorguille
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4482 M456T4063 456.300018310547 456.300018310547 456.300018310547 4063.31637030608 4063.31637030608 4063.31637030608 1 0 1 5798 2.72628805822869 0.978237207749126 0.479614889836939
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lecorguille
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4483 M456T3705 456.399993896484 456.399993896484 456.399993896484 3704.78539729919 3704.78539729919 3704.78539729919 1 1 0 1184 1.01383067277766 0.00971236758629161 0.993132628289532
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lecorguille
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4484 M456T3669 456.399993896484 456.399993896484 456.399993896484 3668.80508470333 3668.80508470333 3668.80508470333 1 0 1 448 3.39900561567259 0.677100856014012 0.607091861603689
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lecorguille
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4485 M456T4230 456.5 456.5 456.5 4229.73915089905 4229.73915089905 4229.73915089905 1 0 1 5424 Inf 1 0.5
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lecorguille
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4486 M457T2796 456.700012207031 456.700012207031 456.700012207031 2795.53226687069 2795.53226687069 2795.53226687069 1 0 1 3942 Inf 1 0.5
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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4491 M457T3285 457.200012207031 457.200012207031 457.200012207031 3284.67583418109 3284.67583418109 3284.67583418109 1 1 0 [83][M+1]- 1228 1.78760935409946 -1.92708858055442 0.292045350046954
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4495 M457T3501 457.399993896484 457.399993896484 457.399993896484 3500.93050564996 3500.93050564996 3500.93050564996 1 1 0 3378 Inf -1 0.5
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lecorguille
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lecorguille
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4497 M457T3156 457.399993896484 457.399993896484 457.399993896484 3155.94747626332 3155.94747626332 3155.94747626332 1 0 1 839 Inf 1 0.5
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lecorguille
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4498 M457T3971 457.399993896484 457.399993896484 457.399993896484 3971.12871400763 3971.12871400763 3971.12871400763 1 0 1 2046 5.65222451535783 0.810491559603085 0.559834021719607
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lecorguille
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4499 M457T3223 457.399993896484 457.399993896484 457.399993896484 3222.51958045772 3222.51958045772 3222.51958045772 1 1 0 4280 3.66205453660093 -0.701253855971636 0.597945355735839
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4500 M458T3942 457.899993896484 457.899993896484 457.899993896484 3941.5190123983 3941.5190123983 3941.5190123983 1 0 1 4157 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4501 M458T2823 457.899993896484 457.899993896484 457.899993896484 2823.02392446804 2823.02392446804 2823.02392446804 1 0 1 3300 Inf 1 0.5
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lecorguille
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4502 M458T3705 458 458 458 3705.00880068764 3705.00880068764 3705.00880068764 1 0 1 17 1.1930493190823 0.124010571287145 0.912951770845813
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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4504 M458T3348 458 458 458 3347.8458781399 3347.8458781399 3347.8458781399 1 0 1 733 Inf 1.43960005173149 0.386503203373447
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lecorguille
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4505 M458T3256 458 458 458 3255.91054716351 3255.91054716351 3255.91054716351 1 0 1 1923 Inf 1 0.5
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lecorguille
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4506 M458T4135 458 458 458 4134.71155413718 4134.71155413718 4134.71155413718 1 1 0 3985 2.50425963177094 -0.748355854633723 0.548921211111845
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lecorguille
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lecorguille
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4508 M458T4182 458.100006103516 458.100006103516 458.100006103516 4181.68550617079 4181.68550617079 4181.68550617079 1 1 0 6011 1.20962934352647 -0.133567857211628 0.906352866107803
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4510 M458T2933 458.200012207031 458.200012207031 458.200012207031 2932.79635982935 2928.01486524893 2937.57785440976 2 0 2 3619 1.39932231487283 -0.299325470289686 0.813508930702565
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4511 M458T3083 458.300018310547 458.300018310547 458.300018310547 3083.31567150771 3080.18550236394 3086.44584065149 2 1 1 3525 1.19663567025382 -0.126091598151267 0.911512931415917
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4512 M458T3141 458.300018310547 458.300018310547 458.300018310547 3140.87578531608 3140.87578531608 3140.87578531608 1 0 1 67 2.23616250915448 0.756763088496013 0.583320947303915
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4513 M458T3642 458.300018310547 458.300018310547 458.300018310547 3641.92509656914 3641.92509656914 3641.92509656914 1 0 1 1527 1.68069039891 0.611685776224206 0.629060333032688
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4514 M458T3370 458.300018310547 458.300018310547 458.300018310547 3369.69547242794 3369.69547242794 3369.69547242794 1 1 0 5763 2.84776559062172 -0.646625198210628 0.63338957395314
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4515 M458T2902 458.399993896484 458.399993896484 458.399993896484 2901.61590100686 2901.61590100686 2901.61590100686 1 0 1 4778 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4516 M458T3421 458.399993896484 458.399993896484 458.399993896484 3421.06898084216 3421.06898084216 3421.06898084216 1 1 0 855 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4517 M459T4086 458.800018310547 458.800018310547 458.800018310547 4086.12110918763 4086.12110918763 4086.12110918763 1 1 0 4961 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4518 M459T2967 458.800018310547 458.800018310547 458.800018310547 2967.14999730349 2967.14999730349 2967.14999730349 1 0 1 3264 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4519 M459T2725 458.899993896484 458.899993896484 458.899993896484 2725.1222289381 2720.07390364244 2730.17055423377 2 1 1 2504 1.49532710280369 0.275351612708293 0.812157961356182
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lecorguille
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4520 M459T2752 458.899993896484 458.899993896484 458.899993896484 2752.14173789035 2752.14173789035 2752.14173789035 1 1 0 4357 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4521 M459T4172 459 459 459 4172.42311655854 4172.42311655854 4172.42311655854 1 1 0 4374 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4522 M459T3236 459 459 459 3236.24872401132 3236.24872401132 3236.24872401132 1 0 1 [M+Cl]- 424.028 54 Inf 4.41406898890893 0.141831045070831
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4523 M459T3618 459 459 459 3617.86438920612 3617.86438920612 3617.86438920612 1 0 1 2589 Inf 1 0.5
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4525 M459T4115 459.100006103516 459.100006103516 459.100006103516 4115.17072749388 4112.99752358033 4117.34393140744 2 1 1 [85][M]- 43 1.12817668029265 -0.0959808215218832 0.932304752666463
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4528 M459T3497 459.200012207031 459.200012207031 459.200012207031 3496.50654000339 3496.50654000339 3496.50654000339 1 0 1 3507 3.85787841054812 1.05440735569771 0.448219426166744
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4529 M459T3038 459.200012207031 459.200012207031 459.200012207031 3038.23244317119 3038.23244317119 3038.23244317119 1 0 1 [84][M+1]- 71 4.14450885364194 0.936083814299714 0.520949480654729
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4530 M459T3447 459.200012207031 459.200012207031 459.200012207031 3446.75991523983 3446.75991523983 3446.75991523983 1 0 1 2931 6.2281998740167 1.04446958961604 0.475397745062296
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4532 M459T3653 459.300018310547 459.300018310547 459.300018310547 3652.96787819215 3652.96787819215 3652.96787819215 1 0 1 2407 Inf 5.66680377568575 0.111197139469626
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lecorguille
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4533 M459T4080 459.300018310547 459.300018310547 459.300018310547 4079.84755767105 4079.84755767105 4079.84755767105 1 1 0 200 1.69423216618309 -0.399772213117559 0.752985748595549
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4534 M459T3876 459.300018310547 459.300018310547 459.300018310547 3875.64648590193 3875.64648590193 3875.64648590193 1 0 1 55 Inf 1.82143447955598 0.319639677072731
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4535 M459T3440 459.300018310547 459.300018310547 459.300018310547 3440.21498381355 3440.21498381355 3440.21498381355 1 1 0 62 1.62371726714177 0.32707586111645 0.780084942247287
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lecorguille
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4536 M459T3414 459.300018310547 459.300018310547 459.300018310547 3414.11616186943 3414.11616186943 3414.11616186943 1 0 1 876 97.4253716615983 1.1187206228973 0.464325885905159
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lecorguille
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4537 M459T3030 459.300018310547 459.300018310547 459.300018310547 3030.39827680018 3030.39827680018 3030.39827680018 1 0 1 2149 Inf 1 0.5
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lecorguille
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4538 M459T2771 459.300018310547 459.300018310547 459.300018310547 2771.04042670827 2771.04042670827 2771.04042670827 1 1 0 5130 Inf -1 0.5
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lecorguille
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4539 M459T3518 459.300018310547 459.300018310547 459.300018310547 3518.13556032481 3518.13556032481 3518.13556032481 1 1 0 353 1.12295695850432 -0.108790318915156 0.923398661324766
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4540 M459T3689 459.399993896484 459.399993896484 459.399993896484 3689.29376228834 3689.29376228834 3689.29376228834 1 0 1 602 Inf 1 0.5
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lecorguille
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4541 M459T3509 459.399993896484 459.399993896484 459.399993896484 3509.36563736658 3509.36563736658 3509.36563736658 1 1 0 4527 Inf -1 0.5
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lecorguille
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4542 M460T2684 459.899993896484 459.899993896484 459.899993896484 2684.06586984756 2684.06586984756 2684.06586984756 1 0 1 658 2.74015727379596 0.596572146102374 0.639932539669863
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lecorguille
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4543 M460T2938 459.899993896484 459.899993896484 459.899993896484 2937.57785440976 2937.57785440976 2937.57785440976 1 0 1 57 1.37106205207283 -0.218657580152506 0.848857028686503
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lecorguille
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4544 M460T2595 459.899993896484 459.899993896484 459.899993896484 2595.175668269 2595.175668269 2595.175668269 1 0 1 2898 2.23896493109577 0.505259762202537 0.682060852340811
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lecorguille
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4545 M460T4077 460 460 460 4076.71052283205 4076.71052283205 4076.71052283205 1 1 0 3898 6.58683725663967 -0.838573119215274 0.550702782247162
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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4565 M461T2858 460.800018310547 460.800018310547 460.800018310547 2857.92685897378 2857.92685897378 2857.92685897378 1 0 1 4264 Inf 1 0.5
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lecorguille
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4566 M461T2784 460.800018310547 460.800018310547 460.800018310547 2783.54584377994 2783.54584377994 2783.54584377994 1 0 1 919 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4567 M461T2832 460.899993896484 460.899993896484 460.899993896484 2832.16930686469 2832.16930686469 2832.16930686469 1 1 0 4582 Inf -1 0.5
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lecorguille
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lecorguille
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lecorguille
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4570 M461T3772 461 461 461 3772.21824064541 3772.21824064541 3772.21824064541 1 0 1 997 Inf 1 0.5
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lecorguille
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4571 M461T3984 461 461 461 3984.11092292181 3984.11092292181 3984.11092292181 1 1 0 4500 Inf -1 0.5
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4578 M461T3300 461.300018310547 461.300018310547 461.300018310547 3299.92951053186 3299.92951053186 3299.92951053186 1 0 1 2606 2.83177539471949 0.6099499303218 0.634210388871029
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lecorguille
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4579 M461T3253 461.300018310547 461.300018310547 461.300018310547 3252.73571149168 3252.73571149168 3252.73571149168 1 1 0 1924 1.62710604707716 -0.328355942878899 0.779309939954406
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4580 M461T3858 461.300018310547 461.300018310547 461.300018310547 3857.79163814401 3857.79163814401 3857.79163814401 1 1 0 21 14.2205039320461 -10.4908232118064 0.0111514907812595
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4581 M461T3151 461.300018310547 461.300018310547 461.300018310547 3151.1761076694 3151.1761076694 3151.1761076694 1 0 1 3039 Inf 1 0.5
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lecorguille
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4582 M461T3931 461.300018310547 461.300018310547 461.300018310547 3930.87032184293 3930.87032184293 3930.87032184293 1 1 0 3005 4.07387312128965 -0.732779824766606 0.586438613590976
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4583 M461T3571 461.300018310547 461.300018310547 461.300018310547 3571.09002855495 3571.09002855495 3571.09002855495 1 1 0 1629 1.42431088196551 -0.288390516964957 0.816785034612039
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4586 M461T2878 461.399993896484 461.399993896484 461.399993896484 2878.10295048572 2878.10295048572 2878.10295048572 1 0 1 4722 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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4590 M461T4023 461.399993896484 461.399993896484 461.399993896484 4022.90524572317 4022.90524572317 4022.90524572317 1 0 1 5579 Inf 1 0.5
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lecorguille
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4591 M461T3542 461.399993896484 461.399993896484 461.399993896484 3542.48800928712 3542.48800928712 3542.48800928712 1 1 0 2328 3.98834993501296 -0.726773373371781 0.58859527385893
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4592 M461T4182 461.399993896484 461.399993896484 461.399993896484 4181.84656269688 4181.84656269688 4181.84656269688 1 1 0 6012 Inf -1 0.5
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lecorguille
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4593 M461T3742 461.399993896484 461.399993896484 461.399993896484 3742.33047859757 3742.33047859757 3742.33047859757 1 1 0 1066 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4594 M462T4136 461.5 461.5 461.5 4136.2093331095 4136.2093331095 4136.2093331095 1 0 1 3987 Inf 1 0.5
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lecorguille
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4595 M462T2815 461.5 461.5 461.5 2815.26974759249 2815.26974759249 2815.26974759249 1 0 1 3301 Inf 1 0.5
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lecorguille
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4596 M462T2749 461.700012207031 461.700012207031 461.700012207031 2748.58073904465 2745.01974019894 2752.14173789035 2 1 1 4358 1.34393986544564 -0.205317132786211 0.857698600273704
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lecorguille
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4597 M462T2899 461.800018310547 461.800018310547 461.800018310547 2898.92238702059 2898.92238702059 2898.92238702059 1 1 0 4773 Inf -1 0.5
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lecorguille
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4598 M462T3054 461.899993896484 461.899993896484 461.899993896484 3054.33161226052 3052.12776689882 3056.53545762222 2 1 1 3496 1.6222664015904 -0.326526537344247 0.780417808573962
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4599 M462T4296 461.899993896484 461.899993896484 461.899993896484 4295.86018683105 4293.12322276304 4298.59715089905 2 1 1 6140 1.39936608557853 -0.232196435042088 0.83995999761304
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4600 M462T2665 461.899993896484 461.899993896484 461.899993896484 2664.7542722242 2664.7542722242 2664.7542722242 1 0 1 2267 Inf 16.4605564137695 0.03862799599642
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lecorguille
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4601 M462T2905 461.899993896484 461.899993896484 461.899993896484 2905.17015173569 2905.17015173569 2905.17015173569 1 1 0 3921 15.6319406874832 -0.934118990721687 0.520660147847953
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4602 M462T3736 461.899993896484 461.899993896484 461.899993896484 3736.28346343246 3736.28346343246 3736.28346343246 1 0 1 5198 Inf 1 0.5
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lecorguille
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4603 M462T2744 461.899993896484 461.899993896484 461.899993896484 2744.27300671808 2744.27300671808 2744.27300671808 1 1 0 4616 6.81361475091199 -0.844191539280392 0.548899067125229
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4604 M462T4401 461.899993896484 461.899993896484 461.899993896484 4401.10522276304 4401.10522276304 4401.10522276304 1 1 0 322 Inf -1 0.5
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lecorguille
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4605 M462T2597 461.899993896484 461.899993896484 461.899993896484 2596.59397459635 2596.59397459635 2596.59397459635 1 1 0 2880 6.25806451612912 -0.829680397744353 0.553572557285694
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4606 M462T2926 461.899993896484 461.899993896484 461.899993896484 2926.46996534627 2926.46996534627 2926.46996534627 1 0 1 2873 8.54061184575908 0.87692174711836 0.538513204625847
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lecorguille
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4607 M462T4296 462 462 462 4295.91544766554 4292.33715089905 4299.49374443202 2 0 2 6141 2.11900096469405 1.61954398581078 0.25005134975835
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lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4611 M462T3126 462 462 462 3125.8362635856 3125.8362635856 3125.8362635856 1 1 0 5087 1.36492723709579 0.52937666650364 0.653294027623635
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4612 M462T2962 462 462 462 2962.41416054475 2962.41416054475 2962.41416054475 1 0 1 3265 Inf 1.31742838850656 0.413338675969748
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4614 M462T3936 462.100006103516 462.100006103516 462.100006103516 3936.43507866832 3936.43507866832 3936.43507866832 1 0 1 4158 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4615 M462T3551 462.100006103516 462.100006103516 462.100006103516 3551.1449925006 3551.1449925006 3551.1449925006 1 0 1 2352 1.5956491959714 0.37786061625089 0.745113190447058
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4616 M462T3624 462.100006103516 462.100006103516 462.100006103516 3623.71381034844 3623.71381034844 3623.71381034844 1 0 1 1619 6.63046936136289 0.839684933683559 0.550345290753984
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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4618 M462T4422 462.200012207031 462.200012207031 462.200012207031 4421.55974443202 4421.55974443202 4421.55974443202 1 0 1 296 18.314619135698 0.943992699207193 0.517587783892788
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lecorguille
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4619 M462T3342 462.200012207031 462.200012207031 462.200012207031 3341.65881977194 3341.65881977194 3341.65881977194 1 0 1 [M+Cl]- 427.235 [M-H]- 463.21 9 4.83292093334664 0.944802507299306 0.51485237301627
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4620 M462T3377 462.200012207031 462.200012207031 462.200012207031 3377.12051467197 3377.12051467197 3377.12051467197 1 0 1 25 1.5016545941004 0.287270063220636 0.804908528177465
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4621 M462T2633 462.300018310547 462.300018310547 462.300018310547 2633.23634656023 2633.23634656023 2633.23634656023 1 1 0 2658 Inf -1 0.5
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lecorguille
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4622 M462T3837 462.300018310547 462.300018310547 462.300018310547 3837.34147794623 3837.34147794623 3837.34147794623 1 1 0 3168 7.68900931219036 0.997311514976932 0.49503996123008
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lecorguille
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4623 M462T4433 462.300018310547 462.300018310547 462.300018310547 4432.51474443202 4432.51474443202 4432.51474443202 1 0 1 320 1.57062146892651 0.306464707980115 0.792691202738642
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lecorguille
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4624 M462T2658 462.300018310547 462.300018310547 462.300018310547 2658.32517788127 2658.32517788127 2658.32517788127 1 1 0 4068 2.4004412799638 0.538546887613588 0.66606928068122
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lecorguille
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4625 M462T3654 462.300018310547 462.300018310547 462.300018310547 3654.40667855991 3654.40667855991 3654.40667855991 1 1 0 [M-H-CH2]- 477.328 47 11.6642633973312 -0.910926542914128 0.527876201944846
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4626 M462T4397 462.300018310547 462.300018310547 462.300018310547 4397.18915089905 4397.18915089905 4397.18915089905 1 0 1 6110 4.46896551724112 0.757501772423918 0.577726302362594
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4627 M462T4052 462.300018310547 462.300018310547 462.300018310547 4051.5360932026 4051.5360932026 4051.5360932026 1 0 1 3430 2.40053654510959 0.748954234939978 0.559118531916305
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4628 M462T3280 462.399993896484 462.399993896484 462.399993896484 3279.90396347494 3279.90396347494 3279.90396347494 1 1 0 1245 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4629 M462T2900 462.399993896484 462.399993896484 462.399993896484 2899.5217296201 2899.5217296201 2899.5217296201 1 1 0 4779 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4630 M462T3850 462.399993896484 462.399993896484 462.399993896484 3849.91783917266 3849.91783917266 3849.91783917266 1 1 0 1396 Inf -1 0.5
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lecorguille
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4631 M462T4158 462.399993896484 462.399993896484 462.399993896484 4157.91287309858 4157.91287309858 4157.91287309858 1 0 1 311 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4632 M462T2814 462.5 462.5 462.5 2813.62324605292 2813.62324605292 2813.62324605292 1 0 1 3326 12.3331303500536 1.04706717535584 0.483026513475566
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4633 M462T3189 462.5 462.5 462.5 3189.32784141832 3189.32784141832 3189.32784141832 1 0 1 2198 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4634 M463T3759 462.600006103516 462.600006103516 462.600006103516 3758.87240197312 3758.87240197312 3758.87240197312 1 1 0 999 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4635 M463T2796 462.800018310547 462.800018310547 462.800018310547 2795.53226687069 2795.53226687069 2795.53226687069 1 0 1 3943 3.33698593791521 0.670853525637662 0.609507403137091
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4636 M463T2821 462.899993896484 462.899993896484 462.899993896484 2821.48052115151 2821.48052115151 2821.48052115151 1 0 1 3320 1.052210652525 -0.0521811873734076 0.966796033164976
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4637 M463T4297 463 463 463 4297.03215089905 4297.03215089905 4297.03215089905 1 0 1 6142 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4638 M463T3269 463 463 463 3269.21467689755 3269.21467689755 3269.21467689755 1 0 1 5473 5.39332231181568 0.800934392853446 0.562991595660172
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4639 M463T3513 463 463 463 3513.42292224559 3513.42292224559 3513.42292224559 1 1 0 [M-H-C3H2O3]- 550.007 119 4.50817205096436 -0.778068423193406 0.578990830284314
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4640 M463T2953 463 463 463 2952.96860923202 2952.96860923202 2952.96860923202 1 0 1 3192 2.510881672089 0.674620699633829 0.590267138295548
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4641 M463T3151 463 463 463 3150.79182893267 3150.79182893267 3150.79182893267 1 1 0 3054 3.68504928002116 -0.984367277817746 0.504799637926265
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4642 M463T3977 463 463 463 3977.4365434548 3977.4365434548 3977.4365434548 1 0 1 2048 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4643 M463T3824 463.100006103516 463.100006103516 463.100006103516 3823.50133984197 3820.64233541388 3826.36034427007 2 2 0 1854 4.47032696012273 -3.41964874787567 0.169842115850814
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4644 M463T4113 463.100006103516 463.100006103516 463.100006103516 4112.77437543361 4112.77437543361 4112.77437543361 1 1 0 2308 1.4883210117387 -0.272337977108544 0.814070218951764
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4645 M463T3765 463.100006103516 463.100006103516 463.100006103516 3764.54207690721 3764.54207690721 3764.54207690721 1 1 0 1000 1.63595354529585 -0.331678500686679 0.777302758479193
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4646 M463T3030 463.100006103516 463.100006103516 463.100006103516 3030.39059110099 3030.39059110099 3030.39059110099 1 0 1 2125 3.59634723685323 0.931721820317978 0.520046342573345
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4647 M463T3045 463.200012207031 463.200012207031 463.200012207031 3044.50069244491 3044.50069244491 3044.50069244491 1 0 1 4957 2.0866046480869 0.827520131711537 0.559890543490684
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4648 M463T3641 463.200012207031 463.200012207031 463.200012207031 3641.16551997803 3641.16551997803 3641.16551997803 1 1 0 59 3.93380112395251 -1.86226458294041 0.299684018529851
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4649 M463T2790 463.200012207031 463.200012207031 463.200012207031 2790.01449146275 2790.01449146275 2790.01449146275 1 0 1 900 Inf 1.73443403801609 0.332954421497212
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4650 M463T2935 463.300018310547 463.300018310547 463.300018310547 2934.53821802855 2934.53821802855 2934.53821802855 1 0 1 2812 1.61668461761604 -0.324406032399347 0.781704361712116
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4651 M463T3708 463.399993896484 463.399993896484 463.399993896484 3708.1445343506 3708.1445343506 3708.1445343506 1 0 1 1162 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4652 M463T2919 463.399993896484 463.399993896484 463.399993896484 2919.11601170016 2919.11601170016 2919.11601170016 1 0 1 2774 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4653 M463T4146 463.399993896484 463.399993896484 463.399993896484 4145.51429793861 4145.51429793861 4145.51429793861 1 0 1 219 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4654 M463T2950 463.399993896484 463.399993896484 463.399993896484 2949.79655795618 2949.79655795618 2949.79655795618 1 0 1 3193 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4655 M464T4048 463.5 463.5 463.5 4047.7904766663 4047.7904766663 4047.7904766663 1 0 1 4119 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4656 M464T2691 463.899993896484 463.899993896484 463.899993896484 2691.44503823285 2691.44503823285 2691.44503823285 1 1 0 659 2.8306705528926 -0.609793568959177 0.634276632396974
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4657 M464T3744 463.899993896484 463.899993896484 463.899993896484 3743.91030943196 3743.91030943196 3743.91030943196 1 1 0 1067 7.24396511647783 -0.85385661469801 0.545811899482809
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4658 M464T3978 463.899993896484 463.899993896484 463.899993896484 3978.24414308204 3978.24414308204 3978.24414308204 1 1 0 2049 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4659 M464T3199 464 464 464 3198.84156835264 3198.84156835264 3198.84156835264 1 0 1 [M-H-COCH2]- 507.026 30 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4660 M464T3412 464.100006103516 464.100006103516 464.100006103516 3412.35023347979 3409.6137638498 3415.08670310979 2 1 1 877 1.06808261672027 0.0819296985717793 0.942166723013746
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4661 M464T3504 464.100006103516 464.100006103516 464.100006103516 3504.22462616196 3504.22462616196 3504.22462616196 1 0 1 76 2.19861966781587 0.972017285025381 0.507154365863282
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4662 M464T4086 464.100006103516 464.100006103516 464.100006103516 4086.20649646532 4086.20649646532 4086.20649646532 1 0 1 4983 4.9691873171821 0.783061164516624 0.568974445382207
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4663 M464T3462 464.100006103516 464.100006103516 464.100006103516 3462.3352029731 3462.3352029731 3462.3352029731 1 0 1 1280 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4664 M464T3608 464.100006103516 464.100006103516 464.100006103516 3607.63068122743 3607.63068122743 3607.63068122743 1 1 0 4673 1.69788729087973 -0.354169852422723 0.763885559019202
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4665 M464T3459 464.200012207031 464.200012207031 464.200012207031 3459.11913513146 3451.53866392025 3468.45294302651 5 2 2 [86][M]- 19 1.7187799973902 -1.55011081631587 0.364615081111472
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4666 M464T2520 464.300018310547 464.300018310547 464.300018310547 2520.20428676082 2520.20428676082 2520.20428676082 1 1 0 5041 1.29507676558922 -0.185049926652431 0.871775616227226
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4667 M464T3856 464.300018310547 464.300018310547 464.300018310547 3855.84399832511 3855.84399832511 3855.84399832511 1 1 0 [87][M]- [M+Cl+NaCOOH]- 361.338 21 7.5522068862958 -0.896538257575338 0.532185607069991
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4668 M464T4205 464.300018310547 464.300018310547 464.300018310547 4205.40135219481 4205.40135219481 4205.40135219481 1 1 0 4920 1.96653694564663 -0.53474306873081 0.66138881525974
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4669 M464T3289 464.399993896484 464.399993896484 464.399993896484 3289.10475211434 3289.10475211434 3289.10475211434 1 0 1 2115 Inf 1 0.5
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4672 M464T2863 464.399993896484 464.399993896484 464.399993896484 2862.7122055865 2862.7122055865 2862.7122055865 1 1 0 3650 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4673 M465T3942 464.600006103516 464.600006103516 464.600006103516 3941.77857116674 3941.77857116674 3941.77857116674 1 1 0 4176 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4674 M465T2565 464.700012207031 464.700012207031 464.700012207031 2565.29497459635 2565.29497459635 2565.29497459635 1 1 0 5870 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4675 M465T2965 464.800018310547 464.800018310547 464.800018310547 2965.24607563025 2965.24607563025 2965.24607563025 1 0 1 3266 Inf 5.43040100187915 0.115933734154896
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4677 M465T2730 464.899993896484 464.899993896484 464.899993896484 2729.64154392209 2729.64154392209 2729.64154392209 1 0 1 2505 1.96489192470601 -1.29244529621908 0.404388653573959
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4679 M465T4110 465.100006103516 465.100006103516 465.100006103516 4109.84516095031 4106.73892937947 4109.84516095031 3 0 2 [M-H-CO]- 494.106 43 2.67576623688493 0.789425095678841 0.564347963384312
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4681 M465T4216 465.100006103516 465.100006103516 465.100006103516 4215.55989845916 4215.55989845916 4215.55989845916 1 0 1 5328 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4682 M465T3460 465.200012207031 465.200012207031 465.200012207031 3460.0496945999 3457.15654781979 3460.80362206259 4 2 2 [86][M+1]- 19 1.08348267136266 -0.640248019276023 0.627594645416371
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4683 M465T3713 465.300018310547 465.300018310547 465.300018310547 3712.84413919545 3712.84413919545 3712.84413919545 1 0 1 1158 2.4811081466428 0.901766720447144 0.467769988668099
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4684 M465T3856 465.300018310547 465.300018310547 465.300018310547 3855.84399832511 3855.84399832511 3855.84399832511 1 1 0 [87][M+1]- 21 8.13831055076039 -0.903854437605541 0.531079711010448
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4685 M465T3413 465.300018310547 465.300018310547 465.300018310547 3412.5681972288 3412.5681972288 3412.5681972288 1 0 1 878 5.22059015931287 0.794015344530126 0.565295208621972
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4686 M465T4081 465.399993896484 465.399993896484 465.399993896484 4081.47888012129 4081.47888012129 4081.47888012129 1 0 1 5727 7.0394530096363 1.26093816712265 0.413390022695646
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4687 M465T2961 465.399993896484 465.399993896484 465.399993896484 2960.60185152721 2960.60185152721 2960.60185152721 1 0 1 3267 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4688 M465T3714 465.399993896484 465.399993896484 465.399993896484 3713.82640836776 3713.82640836776 3713.82640836776 1 1 0 1185 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4689 M466T2860 465.5 465.5 465.5 2859.59099996184 2859.59099996184 2859.59099996184 1 1 0 4251 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4690 M466T4012 465.5 465.5 465.5 4011.99741513287 4011.99741513287 4011.99741513287 1 0 1 5226 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4691 M466T2628 465.700012207031 465.700012207031 465.700012207031 2628.18204956049 2628.18204956049 2628.18204956049 1 0 1 2660 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4692 M466T2529 465.899993896484 465.899993896484 465.899993896484 2529.30097459635 2529.30097459635 2529.30097459635 1 1 0 5600 3.01463766365306 -0.667864862942926 0.624911011319158
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4693 M466T3046 465.899993896484 465.899993896484 465.899993896484 3045.55609609406 3045.55609609406 3045.55609609406 1 1 0 4951 Inf -2.42384595568584 0.249105012725962
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4694 M466T2646 465.899993896484 465.899993896484 465.899993896484 2646.41158613548 2646.41158613548 2646.41158613548 1 0 1 5943 1.28883525249187 0.199000938566195 0.865846743460419
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4695 M466T3989 465.899993896484 465.899993896484 465.899993896484 3989.36430026676 3989.36430026676 3989.36430026676 1 1 0 4475 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4696 M466T2934 465.899993896484 465.899993896484 465.899993896484 2934.21377019929 2934.21377019929 2934.21377019929 1 0 1 2813 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4697 M466T3983 466 466 466 3983.43908551935 3983.01028213959 3983.86788889911 2 1 1 4473 1.44921878546336 -0.255129451697238 0.825075720354248
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4698 M466T3382 466 466 466 3381.76815667381 3381.76815667381 3381.76815667381 1 1 0 1578 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4699 M466T3478 466.100006103516 466.100006103516 466.100006103516 3477.71222876477 3477.71222876477 3477.71222876477 1 1 0 1799 1.25783878307374 -0.16045631066481 0.887922725222215
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4700 M466T3466 466.100006103516 466.100006103516 466.100006103516 3465.60554756889 3465.60554756889 3465.60554756889 1 0 1 4031 Inf 1.49200758394472 0.375905455419646
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4701 M466T3448 466.100006103516 466.100006103516 466.100006103516 3447.5917987994 3447.5917987994 3447.5917987994 1 1 0 [M-H]- 467.106 62 14.0794226532023 -1.08561409181532 0.472764768164083
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4702 M466T4135 466.100006103516 466.100006103516 466.100006103516 4134.71155413718 4134.71155413718 4134.71155413718 1 1 0 3988 2.12734930261289 -0.697712849455065 0.611998491458909
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4703 M466T3687 466.200012207031 466.200012207031 466.200012207031 3686.94360702596 3682.48646949786 3692.44181750114 4 2 2 [88][M]- 5 1.24616795835631 -0.653070698457346 0.631606844849624
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4704 M466T3462 466.200012207031 466.200012207031 466.200012207031 3462.21813542294 3454.73998523726 3463.52836290254 3 2 1 [86][M+2]- 19 1.4494670421966 -1.78896799518837 0.324103330464042
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4705 M466T2539 466.200012207031 466.200012207031 466.200012207031 2538.98328676082 2538.98328676082 2538.98328676082 1 1 0 5561 4.82061151964476 -2.33168392813832 0.251210319752566
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4706 M466T3188 466.200012207031 466.200012207031 466.200012207031 3187.97882224249 3187.97882224249 3187.97882224249 1 1 0 40 3.19853398121303 -2.1781053027837 0.16350162769106
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4707 M466T3495 466.200012207031 466.200012207031 466.200012207031 3494.73645383791 3494.73645383791 3494.73645383791 1 1 0 3504 1.31497702964799 0.584179552539704 0.632074080190147
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4708 M466T3734 466.200012207031 466.200012207031 466.200012207031 3734.44922651774 3734.44922651774 3734.44922651774 1 1 0 84 1.42238995386789 -0.352355884167375 0.758237850404809
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4709 M466T3730 466.300018310547 466.300018310547 466.300018310547 3729.51399364127 3729.51399364127 3729.51399364127 1 0 1 3571 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4710 M466T2712 466.399993896484 466.399993896484 466.399993896484 2712.46713466996 2712.46713466996 2712.46713466996 1 1 0 2506 Inf -1.75282341543231 0.330056771333078
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4711 M466T4113 466.399993896484 466.399993896484 466.399993896484 4112.94133253275 4112.94133253275 4112.94133253275 1 0 1 43 2.64472975180657 0.581696301111859 0.646426850840958
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4712 M466T2592 466.399993896484 466.399993896484 466.399993896484 2592.19128676082 2592.19128676082 2592.19128676082 1 1 0 2900 2.10204558455567 -0.473430449916371 0.698046118912544
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4713 M466T2799 466.399993896484 466.399993896484 466.399993896484 2799.13636011264 2799.13636011264 2799.13636011264 1 1 0 3944 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4714 M466T3874 466.5 466.5 466.5 3873.56633408971 3873.56633408971 3873.56633408971 1 1 0 2747 Inf -1 0.5
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lecorguille
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4715 M466T2906 466.5 466.5 466.5 2905.83727345606 2905.83727345606 2905.83727345606 1 1 0 3930 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4716 M466T3323 466.5 466.5 466.5 3323.09295092531 3323.09295092531 3323.09295092531 1 0 1 1147 Inf 1 0.5
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lecorguille
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4717 M466T2934 466.5 466.5 466.5 2933.82801434915 2933.82801434915 2933.82801434915 1 1 0 2814 Inf -1 0.5
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lecorguille
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4718 M467T3937 466.800018310547 466.800018310547 466.800018310547 3936.93935391593 3936.93935391593 3936.93935391593 1 1 0 4159 Inf -1 0.5
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lecorguille
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4719 M467T3989 466.899993896484 466.899993896484 466.899993896484 3988.82059747367 3988.82059747367 3988.82059747367 1 1 0 4501 Inf -4.20288839186686 0.148706946294248
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lecorguille
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4720 M467T4122 467 467 467 4122.06642147928 4122.06642147928 4122.06642147928 1 1 0 1732 Inf -1 0.5
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lecorguille
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4721 M467T4110 467 467 467 4109.63932175949 4109.63932175949 4109.63932175949 1 1 0 2309 9.71618051182354 -0.89236504752733 0.5336688033454
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4722 M467T3329 467 467 467 3328.90967134892 3328.90967134892 3328.90967134892 1 1 0 1114 Inf -1 0.5
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lecorguille
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4723 M467T3387 467 467 467 3386.51298404383 3386.51298404383 3386.51298404383 1 0 1 1579 4.10468960535946 1.48962607227877 0.307730181187178
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4724 M467T3354 467 467 467 3353.97205897406 3353.97205897406 3353.97205897406 1 1 0 690 Inf -1 0.5
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lecorguille
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4725 M467T3492 467.100006103516 467.100006103516 467.100006103516 3491.65134086927 3491.65134086927 3491.65134086927 1 1 0 1800 Inf -2.33522060067474 0.257575808867146
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lecorguille
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4726 M467T3744 467.100006103516 467.100006103516 467.100006103516 3744.08158908687 3744.08158908687 3744.08158908687 1 0 1 1022 Inf 1 0.5
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lecorguille
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4727 M467T3458 467.100006103516 467.100006103516 467.100006103516 3457.87780203005 3457.87780203005 3457.87780203005 1 0 1 1281 1.1433959827185 0.094401704170115 0.933531070241723
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lecorguille
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4728 M467T4074 467.100006103516 467.100006103516 467.100006103516 4074.17695874045 4074.17695874045 4074.17695874045 1 0 1 3900 3.81982010632587 4.36454755075203 0.0492672945954471
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lecorguille
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4729 M467T3957 467.100006103516 467.100006103516 467.100006103516 3957.20033474785 3957.20033474785 3957.20033474785 1 0 1 5396 8.03774043117554 1.20173224573213 0.433056549249603
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lecorguille
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4730 M467T3196 467.100006103516 467.100006103516 467.100006103516 3195.5727009703 3195.5727009703 3195.5727009703 1 0 1 30 1.12774970935156 0.109248496413004 0.924816846804685
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lecorguille
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4731 M467T3835 467.100006103516 467.100006103516 467.100006103516 3834.72764209412 3834.72764209412 3834.72764209412 1 0 1 3356 4.58233035795252 0.763794431003189 0.575548699075698
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lecorguille
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4732 M467T3688 467.200012207031 467.200012207031 467.200012207031 3688.48328759837 3680.90199303028 3692.44181750114 4 2 2 [88][M+1]- 5 1.40343661281594 -0.986197839617538 0.466257721428044
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4733 M467T3652 467.300018310547 467.300018310547 467.300018310547 3652.41745633596 3651.37987508858 3653.45503758334 2 1 1 47 1.16458816231359 0.338296342003687 0.781535587361501
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4734 M467T4146 467.300018310547 467.300018310547 467.300018310547 4145.69322876345 4145.69322876345 4145.69322876345 1 1 0 5826 2.18782063442665 -1.02647027214372 0.434190276801458
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4735 M467T3876 467.399993896484 467.399993896484 467.399993896484 3876.32627813558 3876.32627813558 3876.32627813558 1 1 0 2748 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4736 M468T4149 467.5 467.5 467.5 4148.8084114526 4148.8084114526 4148.8084114526 1 1 0 6182 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4737 M468T2556 467.800018310547 467.800018310547 467.800018310547 2555.69387657451 2549.791668269 2561.59608488001 2 0 2 3079 8.11964026240086 6.81594851758342 0.068392401907821
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4738 M468T2726 467.899993896484 467.899993896484 467.899993896484 2726.36701510869 2726.36701510869 2726.36701510869 1 1 0 2507 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4739 M468T3002 468 468 468 3002.02396257416 3002.02396257416 3002.02396257416 1 1 0 4092 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4740 M468T3105 468.100006103516 468.100006103516 468.100006103516 3105.32542099572 3105.32542099572 3105.32542099572 1 1 0 3142 8.04396324466125 -0.868993908666048 0.541012158597887
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4741 M468T3913 468.100006103516 468.100006103516 468.100006103516 3913.30169008989 3913.30169008989 3913.30169008989 1 0 1 5150 1.07520583642096 -0.0512177339676552 0.963828909939132
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4742 M468T2628 468.100006103516 468.100006103516 468.100006103516 2628.18204956049 2628.18204956049 2628.18204956049 1 0 1 2661 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4743 M468T2583 468.100006103516 468.100006103516 468.100006103516 2582.655668269 2582.655668269 2582.655668269 1 0 1 197 1.00572792362768 -0.00403867052527138 0.99714425092234
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4744 M468T2939 468.200012207031 468.200012207031 468.200012207031 2939.22991609675 2939.22991609675 2939.22991609675 2 1 0 57 13.7817675184247 -1.04056453444308 0.487322208260163
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4745 M468T3705 468.200012207031 468.200012207031 468.200012207031 3705.28884981637 3703.07760757611 3707.50009205663 2 1 1 1163 3.89809217074854 -7.55156738579413 0.0384248471222399
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4746 M468T3134 468.200012207031 468.200012207031 468.200012207031 3133.93093002572 3130.13495825374 3137.72690179769 2 1 1 4987 1.6683835324011 -1.32637593392695 0.33112079522917
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4747 M468T2921 468.200012207031 468.200012207031 468.200012207031 2921.49590066445 2921.49590066445 2921.49590066445 1 1 0 [M-H-CO2]- 513.205 60 8.42200185479818 -1.07547606739528 0.476590624316173
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4748 M468T3480 468.200012207031 468.200012207031 468.200012207031 3479.51387282006 3479.51387282006 3479.51387282006 1 0 1 [M-H]- 469.208 31 1.53373476082409 0.353455419566102 0.757977755232152
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4749 M468T2935 468.300018310547 468.300018310547 468.300018310547 2934.94322714646 2933.82801434915 2936.05843994377 2 1 1 2794 1.00557849007408 0.00809264552563147 0.994282367879366
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4750 M468T3801 468.300018310547 468.300018310547 468.300018310547 3801.23323615147 3801.23323615147 3801.23323615147 1 1 0 2837 3.16202455449376 0.700783044858972 0.607120564088431
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4751 M468T2755 468.300018310547 468.300018310547 468.300018310547 2754.64826033204 2754.64826033204 2754.64826033204 1 0 1 4602 1.1951047281008 0.19739207193802 0.861881895722809
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4752 M468T3971 468.399993896484 468.399993896484 468.399993896484 3971.21936575744 3967.97576169525 3974.46296981963 2 0 2 1992 Inf 8.86962137588946 0.0714734837424458
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4753 M468T2892 468.399993896484 468.399993896484 468.399993896484 2891.62961500899 2891.62961500899 2891.62961500899 1 1 0 3834 1.15335794121234 -0.100463071504613 0.929303020226063
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4754 M468T3735 468.399993896484 468.399993896484 468.399993896484 3735.48344916275 3735.48344916275 3735.48344916275 1 1 0 3572 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4755 M468T3228 468.399993896484 468.399993896484 468.399993896484 3228.42076834112 3228.42076834112 3228.42076834112 1 1 0 2720 36.6402680258968 -1.02177542354522 0.492922101593266
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4756 M468T2821 468.399993896484 468.399993896484 468.399993896484 2821.48052115151 2821.48052115151 2821.48052115151 1 0 1 3288 3.06526476796391 -0.640539289627956 0.621534331623089
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4757 M468T3992 468.399993896484 468.399993896484 468.399993896484 3991.62863021708 3991.62863021708 3991.62863021708 1 0 1 4502 5.87541887758103 0.818035426741189 0.557360477125015
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4758 M468T2698 468.5 468.5 468.5 2697.66327660635 2697.66327660635 2697.66327660635 1 1 0 5071 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4759 M468T3935 468.5 468.5 468.5 3934.85902482452 3934.85902482452 3934.85902482452 1 0 1 4160 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4760 M469T4220 468.600006103516 468.600006103516 468.600006103516 4219.78742796746 4219.78742796746 4219.78742796746 1 0 1 164 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4761 M469T3826 468.899993896484 468.899993896484 468.899993896484 3826.36034427007 3826.36034427007 3826.36034427007 1 1 0 1888 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4762 M469T4228 468.899993896484 468.899993896484 468.899993896484 4227.52320077638 4227.52320077638 4227.52320077638 1 0 1 5425 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4763 M469T2873 469 469 469 2872.87612722882 2872.87612722882 2872.87612722882 1 1 0 4763 1.27622939239898 -0.17037046097083 0.881182890758193
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4764 M469T3657 469 469 469 3657.49622295636 3657.49622295636 3657.49622295636 1 1 0 2408 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4765 M469T4110 469 469 469 4109.84004353069 4109.84004353069 4109.84004353069 1 0 1 43 1.9014775838084 -0.506558664513921 0.668689529637268
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4766 M469T2793 469 469 469 2793.16296782797 2793.16296782797 2793.16296782797 1 0 1 [M-H+CF3COOH]- 336.012 12 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4767 M469T2864 469.100006103516 469.100006103516 469.100006103516 2863.94789102614 2863.94789102614 2863.94789102614 1 0 1 87 3.7472169908774 0.708345987819703 0.59531558970015
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4768 M469T3487 469.100006103516 469.100006103516 469.100006103516 3487.2917978999 3487.2917978999 3487.2917978999 1 1 0 1801 7.18581782748595 -0.85262051515315 0.546205679755083
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4769 M469T2541 469.100006103516 469.100006103516 469.100006103516 2541.25208488001 2541.25208488001 2541.25208488001 1 0 1 5548 3.51460558301888 0.711931568648855 0.604233984412826
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4770 M469T2751 469.100006103516 469.100006103516 469.100006103516 2751.19758289299 2751.19758289299 2751.19758289299 1 1 0 4359 1.24914206565461 0.155702968223626 0.891165245277588
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4771 M469T3880 469.200012207031 469.200012207031 469.200012207031 3880.35791149708 3880.35791149708 3880.35791149708 1 0 1 132 2.3908901070607 0.55760465496177 0.657774953655708
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4772 M469T3853 469.200012207031 469.200012207031 469.200012207031 3852.67256108496 3852.67256108496 3852.67256108496 1 1 0 [M+Cl+CF3COOH]- 300.234 21 1.3656371302541 0.23016127295914 0.841644836442976
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4773 M469T2936 469.200012207031 469.200012207031 469.200012207031 2936.11631912743 2936.11631912743 2936.11631912743 1 1 0 [M-H]- 470.211 [M-H-CO2]- 514.205 57 11.3309945990673 -1.11718079790612 0.461435844506768
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4774 M469T3038 469.200012207031 469.200012207031 469.200012207031 3037.72407187779 3037.72407187779 3037.72407187779 1 1 0 3225 12.7662265611006 -2.74714461440011 0.201013362007046
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4775 M469T3898 469.300018310547 469.300018310547 469.300018310547 3897.6198681395 3897.6198681395 3897.6198681395 1 0 1 5755 4.96017793161731 0.814299257703678 0.555809008712348
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4776 M469T2725 469.300018310547 469.300018310547 469.300018310547 2725.28754238135 2725.28754238135 2725.28754238135 1 0 1 2456 3.06200273779665 1.64398095575431 0.274990153765135
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4777 M469T3453 469.399993896484 469.399993896484 469.399993896484 3452.86917989958 3452.86917989958 3452.86917989958 1 1 0 74 2.0856347407564 -0.46936643108501 0.700136101476937
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4778 M469T3741 469.399993896484 469.399993896484 469.399993896484 3740.56103194088 3740.56103194088 3740.56103194088 1 0 1 1018 Inf 1.65761809081508 0.345572686720694
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4779 M469T3813 469.399993896484 469.399993896484 469.399993896484 3813.40975648734 3813.40975648734 3813.40975648734 1 0 1 2392 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4780 M469T3957 469.399993896484 469.399993896484 469.399993896484 3957.41697160807 3957.41697160807 3957.41697160807 1 1 0 5397 5.11173077904425 -1.05597759225526 0.475661643145752
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4781 M470T3865 469.5 469.5 469.5 3865.47422517578 3865.47422517578 3865.47422517578 1 0 1 1397 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4782 M470T3904 469.5 469.5 469.5 3903.6249434652 3903.6249434652 3903.6249434652 1 1 0 4841 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4783 M470T4113 469.600006103516 469.600006103516 469.600006103516 4112.94133253275 4112.94133253275 4112.94133253275 1 0 1 2310 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4784 M470T3894 469.899993896484 469.899993896484 469.899993896484 3894.12297190347 3894.12297190347 3894.12297190347 1 1 0 4905 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4785 M470T4048 469.899993896484 469.899993896484 469.899993896484 4048.02955084935 4048.02955084935 4048.02955084935 1 1 0 4120 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4786 M470T2667 469.899993896484 469.899993896484 469.899993896484 2666.86491760675 2666.86491760675 2666.86491760675 1 1 0 4050 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4787 M470T3375 470 470 470 3375.36263818892 3375.36263818892 3375.36263818892 1 0 1 1580 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4788 M470T3255 470 470 470 3255.08398772709 3255.08398772709 3255.08398772709 1 0 1 34 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4789 M470T2744 470.100006103516 470.100006103516 470.100006103516 2744.27300671808 2744.27300671808 2744.27300671808 1 1 0 122 Inf -1.38193884580928 0.398780995171755
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4790 M470T3708 470.100006103516 470.100006103516 470.100006103516 3707.50009205663 3707.50009205663 3707.50009205663 1 0 1 1186 4.02628630651369 0.729469595060514 0.587625171379231
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4791 M470T2918 470.100006103516 470.100006103516 470.100006103516 2917.50807882371 2917.50807882371 2917.50807882371 1 1 0 56 3.79580864690244 -1.37306349620575 0.332595558621619
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4792 M470T3550 470.100006103516 470.100006103516 470.100006103516 3550.11811785475 3550.11811785475 3550.11811785475 1 0 1 2329 2.78239990447484 0.602845437334532 0.63723543502146
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4793 M470T3566 470.100006103516 470.100006103516 470.100006103516 3566.14316934182 3566.14316934182 3566.14316934182 1 1 0 1676 7.09023349055379 -1.06174777954015 0.472601530767615
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lecorguille
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4794 M470T3875 470.100006103516 470.100006103516 470.100006103516 3874.75776665632 3874.75776665632 3874.75776665632 1 1 0 55 2.1739272902197 -0.602473169405529 0.637579901412678
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4795 M470T3628 470.100006103516 470.100006103516 470.100006103516 3627.98198184035 3627.98198184035 3627.98198184035 1 1 0 26 1.27126937905394 -0.214405941758604 0.851190577295411
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4798 M470T4132 470.300018310547 470.300018310547 470.300018310547 4131.57917077552 4131.57917077552 4131.57917077552 1 1 0 1500 19.4635648283718 -0.982900140669758 0.505330774331918
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4800 M470T3785 470.300018310547 470.300018310547 470.300018310547 3784.89909920985 3784.89909920985 3784.89909920985 1 0 1 [89][M]- 88 41.899863672301 1.09679962094305 0.470426053693471
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4801 M470T3382 470.300018310547 470.300018310547 470.300018310547 3381.73613007318 3381.73613007318 3381.73613007318 1 0 1 25 1.72441503724067 0.864895954751509 0.495245373533073
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lecorguille
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4802 M470T3897 470.399993896484 470.399993896484 470.399993896484 3897.28967106009 3897.28967106009 3897.28967106009 1 1 0 5756 Inf -1 0.5
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lecorguille
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4803 M470T3700 470.399993896484 470.399993896484 470.399993896484 3700.09697733735 3700.09697733735 3700.09697733735 1 1 0 4191 1.17864208766611 0.11557337331315 0.918796091178398
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4804 M470T3097 470.399993896484 470.399993896484 470.399993896484 3097.4935938957 3097.4935938957 3097.4935938957 1 1 0 5370 1.1030147498427 0.0691913299754727 0.951185986865491
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lecorguille
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4805 M470T2710 470.399993896484 470.399993896484 470.399993896484 2710.03448589812 2710.03448589812 2710.03448589812 1 1 0 225 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4806 M470T4135 470.399993896484 470.399993896484 470.399993896484 4135.06884588458 4135.06884588458 4135.06884588458 1 0 1 3989 5.19720081605968 1.21277127863531 0.414379758653228
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4807 M470T3605 470.399993896484 470.399993896484 470.399993896484 3604.78487735047 3604.78487735047 3604.78487735047 1 0 1 1434 Inf 1 0.5
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lecorguille
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4808 M470T3730 470.399993896484 470.399993896484 470.399993896484 3729.73564778711 3729.73564778711 3729.73564778711 1 1 0 [M-H-H20]- 489.411 84 1.21134952887552 -0.134550200158445 0.905675943505279
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lecorguille
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4809 M470T2980 470.399993896484 470.399993896484 470.399993896484 2979.80735886393 2979.80735886393 2979.80735886393 1 0 1 5279 Inf 5.18635980373477 0.121260772769923
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lecorguille
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4810 M470T4000 470.399993896484 470.399993896484 470.399993896484 3999.51049102573 3999.51049102573 3999.51049102573 1 0 1 6155 1.2643942679492 -0.233148873472115 0.843016504802935
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4811 M470T4219 470.399993896484 470.399993896484 470.399993896484 4219.24907726518 4219.24907726518 4219.24907726518 1 1 0 5329 7.18199961935005 -0.852538624190258 0.546231778000774
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4812 M470T3443 470.399993896484 470.399993896484 470.399993896484 3443.39350839732 3443.39350839732 3443.39350839732 1 1 0 2932 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4813 M470T4141 470.5 470.5 470.5 4141.37597099195 4141.37597099195 4141.37597099195 1 0 1 4238 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4814 M471T3439 470.800018310547 470.800018310547 470.800018310547 3438.62309535411 3438.62309535411 3438.62309535411 1 1 0 4892 Inf -1 0.5
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lecorguille
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4815 M471T2784 470.899993896484 470.899993896484 470.899993896484 2783.58609771271 2783.58609771271 2783.58609771271 1 1 0 920 Inf -1.16048524613439 0.452797277524432
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4816 M471T2608 470.899993896484 470.899993896484 470.899993896484 2607.54897459635 2607.54897459635 2607.54897459635 1 1 0 4015 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4817 M471T3098 471 471 471 3097.59855190873 3097.59855190873 3097.59855190873 1 1 0 5371 Inf -1.48216058098833 0.377857497280297
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4818 M471T2688 471 471 471 2687.58718990559 2687.58718990559 2687.58718990559 1 0 1 6 2.15821476157627 0.573139189387964 0.637142868631302
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4819 M471T3462 471 471 471 3462.3352029731 3462.3352029731 3462.3352029731 1 0 1 1282 1.66479473981871 0.342316732108581 0.770919290969338
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4820 M471T4211 471 471 471 4211.42241894895 4211.42241894895 4211.42241894895 1 1 0 4934 3.75713175267115 -0.709150670547982 0.595018764551565
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4821 M471T3247 471 471 471 3246.98505522734 3246.98505522734 3246.98505522734 1 1 0 3461 1.60212051104453 -0.318819328953633 0.78510617361118
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4822 M471T3023 471.100006103516 471.100006103516 471.100006103516 3022.65278644104 3022.65278644104 3022.65278644104 1 0 1 2150 2.38866966626656 0.724628537385071 0.557160709774513
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4823 M471T3880 471.300018310547 471.300018310547 471.300018310547 3880.35791149708 3880.35791149708 3880.35791149708 1 0 1 132 9.67390756328905 1.25889075645137 0.420788584696061
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4824 M471T2969 471.300018310547 471.300018310547 471.300018310547 2968.73013674761 2968.73013674761 2968.73013674761 1 0 1 3268 3.45152526459049 1.4453681564785 0.29592765466149
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4825 M471T2628 471.300018310547 471.300018310547 471.300018310547 2628.42193807791 2628.42193807791 2628.42193807791 1 1 0 2662 2.3301148151599 -0.524569123320564 0.672694407252458
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4826 M471T3119 471.300018310547 471.300018310547 471.300018310547 3118.77226932609 3118.77226932609 3118.77226932609 1 0 1 5040 1.81833887632018 0.394346694777735 0.740683084359766
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4827 M471T3782 471.300018310547 471.300018310547 471.300018310547 3781.72876897582 3781.72876897582 3781.72876897582 1 0 1 [89][M+1]- 88 26.0058909241704 1.05668989544315 0.481962660960553
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4828 M471T3430 471.399993896484 471.399993896484 471.399993896484 3430.09276063128 3430.09276063128 3430.09276063128 1 1 0 5269 2.50769629459397 -0.558461933593218 0.656852954614839
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4829 M471T3707 471.399993896484 471.399993896484 471.399993896484 3706.57694442808 3706.57694442808 3706.57694442808 1 0 1 17 Inf 9.71459701533162 0.0653022842879607
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4830 M471T3981 471.399993896484 471.399993896484 471.399993896484 3981.42161936754 3981.42161936754 3981.42161936754 1 1 0 5542 7.80529325374628 -0.864813067435434 0.542333887305052
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4831 M471T2958 471.399993896484 471.399993896484 471.399993896484 2957.68624641973 2957.68624641973 2957.68624641973 1 0 1 3269 Inf 2.31955698770855 0.259129844625357
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4832 M472T2978 471.5 471.5 471.5 2978.26012215575 2978.26012215575 2978.26012215575 1 1 0 5284 2.66159161402851 -0.584398726834289 0.645236659133447
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4833 M472T3541 471.600006103516 471.600006103516 471.600006103516 3540.74689031928 3540.74689031928 3540.74689031928 1 0 1 1931 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4834 M472T2919 471.600006103516 471.600006103516 471.600006103516 2918.73532860671 2918.73532860671 2918.73532860671 1 0 1 2775 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4835 M472T2930 471.899993896484 471.899993896484 471.899993896484 2929.56174569858 2929.56174569858 2929.56174569858 1 0 1 3620 1.05339444879981 0.0383630374770667 0.972894290030367
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4836 M472T2584 471.899993896484 471.899993896484 471.899993896484 2584.07397459635 2584.07397459635 2584.07397459635 1 1 0 5745 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4837 M472T3962 471.899993896484 471.899993896484 471.899993896484 3962.35621613294 3962.35621613294 3962.35621613294 1 1 0 6134 19.3940336607615 -1.62814904616209 0.347822048921534
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4838 M472T3709 472 472 472 3709.21253492763 3709.21253492763 3709.21253492763 1 1 0 1187 Inf -1.68271258696364 0.34135675219524
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4839 M472T2724 472 472 472 2723.94201667569 2723.94201667569 2723.94201667569 1 1 0 2508 3.65461991098405 -0.911197099190153 0.502548720930174
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4840 M472T2925 472 472 472 2925.35523765682 2925.35523765682 2925.35523765682 1 0 1 [M+Cl+HCOOH]- 391.031 [M-H+HCOOH]- 427.008 60 4.64577378100431 -1.11938044334243 0.438136483962987
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lecorguille
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4841 M472T3528 472 472 472 3527.62878275516 3527.62878275516 3527.62878275516 1 1 0 354 2.30213769978564 -0.518790748030744 0.675471206171547
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4842 M472T2671 472 472 472 2671.01298815173 2671.01298815173 2671.01298815173 1 1 0 4051 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4843 M472T3123 472.100006103516 472.100006103516 472.100006103516 3122.69683788133 3122.69683788133 3122.69683788133 1 1 0 5079 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4844 M472T3780 472.300018310547 472.300018310547 472.300018310547 3780.14359305867 3780.14359305867 3780.14359305867 1 0 1 [89][M+2]- 88 10.1977010295827 1.25070372330426 0.423633451196776
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4845 M472T3277 472.399993896484 472.399993896484 472.399993896484 3276.55852937273 3276.55852937273 3276.55852937273 1 0 1 1246 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4846 M472T3478 472.399993896484 472.399993896484 472.399993896484 3477.62927092314 3477.62927092314 3477.62927092314 1 0 1 1802 Inf 1.63511121103232 0.349434315617861
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lecorguille
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4847 M472T4343 472.399993896484 472.399993896484 472.399993896484 4342.88340158956 4342.88340158956 4342.88340158956 1 1 0 6108 Inf -1 0.5
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lecorguille
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4848 M472T2973 472.399993896484 472.399993896484 472.399993896484 2972.99959761349 2972.99959761349 2972.99959761349 1 0 1 3270 2.32504382077725 0.523531211666061 0.673191534842212
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4849 M472T2620 472.399993896484 472.399993896484 472.399993896484 2620.24006617027 2620.24006617027 2620.24006617027 1 0 1 2612 Inf 6.51688559397308 0.0969316618101232
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4850 M472T3359 472.399993896484 472.399993896484 472.399993896484 3358.63038226179 3358.63038226179 3358.63038226179 1 1 0 696 Inf -1.33259761030054 0.409834204260031
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lecorguille
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4851 M472T3778 472.399993896484 472.399993896484 472.399993896484 3778.36705923957 3778.36705923957 3778.36705923957 1 0 1 3677 Inf 1 0.5
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lecorguille
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4852 M472T2586 472.399993896484 472.399993896484 472.399993896484 2585.63897459635 2585.63897459635 2585.63897459635 1 1 0 61 2.79590117503514 -1.14309926624218 0.374981421326669
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lecorguille
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4853 M472T3251 472.399993896484 472.399993896484 472.399993896484 3251.10362433335 3251.10362433335 3251.10362433335 1 0 1 1925 Inf 1 0.5
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lecorguille
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4854 M472T4213 472.5 472.5 472.5 4212.98768677265 4212.98768677265 4212.98768677265 1 1 0 5330 Inf -1 0.5
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lecorguille
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4855 M472T2547 472.5 472.5 472.5 2546.661668269 2546.661668269 2546.661668269 1 0 1 5164 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4856 M473T3380 472.600006103516 472.600006103516 472.600006103516 3380.22886443151 3380.22886443151 3380.22886443151 1 1 0 1581 Inf -1.76565387059134 0.328062061887655
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lecorguille
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4857 M473T3919 472.700012207031 472.700012207031 472.700012207031 3919.08843740074 3919.08843740074 3919.08843740074 1 0 1 3006 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4858 M473T3626 473 473 473 3625.94998801881 3625.94998801881 3625.94998801881 1 0 1 1620 1.42949496590823 0.246192361587188 0.830847436479966
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4860 M473T3153 473.100006103516 473.100006103516 473.100006103516 3153.43154476799 3153.43154476799 3153.43154476799 1 0 1 3056 1.24674620539692 -0.260775911627622 0.837528000797403
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4861 M473T3937 473.200012207031 473.200012207031 473.200012207031 3937.10064224346 3937.10064224346 3937.10064224346 1 1 0 4127 3.66318273923677 -1.32688969787547 0.342902403147748
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4862 M473T3275 473.200012207031 473.200012207031 473.200012207031 3275.12473374223 3275.12473374223 3275.12473374223 1 1 0 5025 1.21289163050406 -0.268710842677735 0.832543379083375
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4863 M473T2551 473.200012207031 473.200012207031 473.200012207031 2550.64208488001 2550.64208488001 2550.64208488001 1 0 1 153 2.14790673094065 0.532069431385056 0.687462581876935
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4864 M473T3664 473.300018310547 473.300018310547 473.300018310547 3663.70033557664 3663.70033557664 3663.70033557664 1 0 1 2 12.9290951868396 0.991156980701024 0.501017971716581
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4865 M473T3471 473.300018310547 473.300018310547 473.300018310547 3471.47237589688 3471.47237589688 3471.47237589688 1 1 0 1803 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4866 M473T2580 473.300018310547 473.300018310547 473.300018310547 2579.67228676082 2579.67228676082 2579.67228676082 1 1 0 5688 Inf -2.00941492938802 0.293972988167227
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4867 M473T3024 473.300018310547 473.300018310547 473.300018310547 3024.20132472852 3024.20132472852 3024.20132472852 1 0 1 2151 Inf 2.18107817102175 0.273676971676486
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4868 M473T3288 473.399993896484 473.399993896484 473.399993896484 3287.55118520376 3287.55118520376 3287.55118520376 1 0 1 2097 14.5776079212831 0.929217879205537 0.522184536976909
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4869 M473T3419 473.399993896484 473.399993896484 473.399993896484 3419.02421978847 3419.02421978847 3419.02421978847 1 1 0 879 2.7103456306052 -0.592032275303757 0.641899712866876
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4870 M473T4036 473.399993896484 473.399993896484 473.399993896484 4035.77395553073 4035.77395553073 4035.77395553073 1 0 1 3771 13.1838619214827 0.921502666311769 0.524584304896338
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4871 M474T3294 473.800018310547 473.800018310547 473.800018310547 3293.7454351085 3293.7454351085 3293.7454351085 1 0 1 5982 6.77329048967952 0.843220886273848 0.549210184502352
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4872 M474T4152 473.899993896484 473.899993896484 473.899993896484 4151.71501127471 4151.71501127471 4151.71501127471 1 0 1 6044 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4873 M474T3294 473.899993896484 473.899993896484 473.899993896484 3294.45848814195 3294.45848814195 3294.45848814195 1 1 0 5983 Inf -1.51152117521202 0.372089227477539
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4874 M474T2855 473.899993896484 473.899993896484 473.899993896484 2854.5094624988 2854.5094624988 2854.5094624988 1 0 1 4265 1.38266353781556 -0.224253592686755 0.845170099944191
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4875 M474T3275 473.899993896484 473.899993896484 473.899993896484 3275.12473374223 3275.12473374223 3275.12473374223 1 1 0 5022 5.48190462846363 -0.804308889359822 0.561873549559894
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4876 M474T3496 474 474 474 3496.27878193711 3496.27878193711 3496.27878193711 1 1 0 3508 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4877 M474T3046 474 474 474 3045.91183806045 3045.91183806045 3045.91183806045 1 0 1 4953 Inf 2.98397047380212 0.20585816615844
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4878 M474T3813 474 474 474 3812.60482106373 3812.60482106373 3812.60482106373 1 1 0 46 267.134552387384 -1.00979317246292 0.496897526726103
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4879 M474T3143 474 474 474 3143.02934283127 3143.02934283127 3143.02934283127 1 1 0 67 2.37372563871116 -0.816974912838188 0.563886643916248
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4880 M474T4174 474 474 474 4173.99308562184 4173.99308562184 4173.99308562184 1 1 0 115 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4881 M474T3072 474.100006103516 474.100006103516 474.100006103516 3072.2568470364 3068.07361938097 3072.37676096677 3 1 2 [M-2H+Na]- 453.112 48 1.12877814883978 1.64546436376453 0.316813690182776
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4882 M474T4132 474.100006103516 474.100006103516 474.100006103516 4131.75994964236 4128.45105340014 4135.06884588458 2 0 2 1501 6.96427625470961 3.12778872115819 0.11160288246738
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4883 M474T3684 474.100006103516 474.100006103516 474.100006103516 3684.06687147297 3684.06687147297 3684.06687147297 1 0 1 604 1.415018428622 0.330638410533601 0.774340157479694
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4884 M474T3301 474.200012207031 474.200012207031 474.200012207031 3301.47496649206 3301.47496649206 3301.47496649206 1 0 1 5389 2.00245563836299 0.821968528248193 0.506201173644832
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4885 M474T3112 474.200012207031 474.200012207031 474.200012207031 3111.56716645676 3111.56716645676 3111.56716645676 1 0 1 5355 1.21117905311891 -0.206356363269356 0.868163680391839
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4886 M474T3894 474.200012207031 474.200012207031 474.200012207031 3894.12297190347 3894.12297190347 3894.12297190347 1 1 0 4906 4.47934583380639 -2.9070403050617 0.119043409548078
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4887 M474T2553 474.200012207031 474.200012207031 474.200012207031 2552.921668269 2552.921668269 2552.921668269 1 0 1 3080 Inf 3.04294473257984 0.202133608850951
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4888 M474T2939 474.200012207031 474.200012207031 474.200012207031 2939.22991609675 2939.22991609675 2939.22991609675 1 1 0 57 10.0041189736317 -1.00487094614371 0.498419434506086
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4889 M474T3712 474.300018310547 474.300018310547 474.300018310547 3712.20655876908 3712.20655876908 3712.20655876908 1 0 1 1188 1.26992131914676 0.221018815610411 0.847669415446634
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4890 M474T3976 474.300018310547 474.300018310547 474.300018310547 3976.03175698205 3976.03175698205 3976.03175698205 1 0 1 2050 1.83350280212591 0.829774891305936 0.557062119504478
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4891 M474T3539 474.300018310547 474.300018310547 474.300018310547 3538.79470195538 3538.79470195538 3538.79470195538 1 1 0 1933 12.3870388641677 -1.74911965603562 0.321954517549779
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4892 M474T2995 474.300018310547 474.300018310547 474.300018310547 2995.47278221695 2995.47278221695 2995.47278221695 1 1 0 1841 Inf -1.23119062130859 0.434269556836773
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4893 M474T3197 474.300018310547 474.300018310547 474.300018310547 3196.54303414977 3196.54303414977 3196.54303414977 1 1 0 1759 3.84979769272787 -1.1214804946446 0.422449703418648
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4894 M474T4008 474.300018310547 474.300018310547 474.300018310547 4007.66168700858 4007.66168700858 4007.66168700858 1 1 0 5227 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4895 M474T2852 474.300018310547 474.300018310547 474.300018310547 2851.50887811 2851.50887811 2851.50887811 1 0 1 6071 Inf 11.9940791702479 0.0529553601547434
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4896 M474T3707 474.399993896484 474.399993896484 474.399993896484 3707.03886468966 3704.36614312564 3709.71158625368 2 0 2 17 4.82525021179723 2.73692363125579 0.111660410774838
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4897 M474T3768 474.399993896484 474.399993896484 474.399993896484 3768.26520496847 3768.26520496847 3768.26520496847 1 1 0 1001 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4898 M474T3172 474.399993896484 474.399993896484 474.399993896484 3172.3019161123 3172.3019161123 3172.3019161123 1 1 0 783 11.0166026890475 -0.905505080595937 0.529565608080196
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4899 M474T3564 474.399993896484 474.399993896484 474.399993896484 3563.69514073502 3563.69514073502 3563.69514073502 1 0 1 1677 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4900 M474T4042 474.399993896484 474.399993896484 474.399993896484 4042.07845977366 4042.07845977366 4042.07845977366 1 0 1 5310 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4901 M474T3531 474.399993896484 474.399993896484 474.399993896484 3530.8102348298 3530.8102348298 3530.8102348298 1 1 0 1969 9.80427055157742 -0.897383238715194 0.53406426398301
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4902 M474T3995 474.399993896484 474.399993896484 474.399993896484 3994.82189698848 3994.82189698848 3994.82189698848 1 0 1 5442 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4903 M474T3740 474.5 474.5 474.5 3740.14810708712 3740.14810708712 3740.14810708712 1 1 0 4716 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4904 M475T3915 474.800018310547 474.800018310547 474.800018310547 3914.72176918889 3914.72176918889 3914.72176918889 1 1 0 5144 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4905 M475T4168 474.899993896484 474.899993896484 474.899993896484 4167.70950191015 4167.70950191015 4167.70950191015 1 1 0 5929 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4906 M475T3739 475 475 475 3739.40336407542 3739.40336407542 3739.40336407542 1 0 1 4717 11.078113596832 0.906048026046483 0.529396341164932
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4907 M475T3814 475 475 475 3814.21237980294 3814.21237980294 3814.21237980294 1 1 0 46 94.3190941454217 -1.01330440110526 0.495761558835791
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4908 M475T3741 475.100006103516 475.100006103516 475.100006103516 3740.75180972326 3740.75180972326 3740.75180972326 1 1 0 [M-2H+Na]- 454.112 14 4.81284395919254 -1.11987441763777 0.454643747075773
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4909 M475T3728 475.100006103516 475.100006103516 475.100006103516 3727.7273314968 3727.7273314968 3727.7273314968 1 1 0 [M-H]- 476.112 84 6.12772285685317 -1.64780349264132 0.344137382826364
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4910 M475T4113 475.100006103516 475.100006103516 475.100006103516 4112.99752358033 4112.99752358033 4112.99752358033 1 0 1 2311 11.3084358935812 1.50227888102142 0.366558763923651
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4911 M475T3882 475.100006103516 475.100006103516 475.100006103516 3881.92802874077 3881.92802874077 3881.92802874077 1 0 1 41 1.08739440529499 0.0715276498507931 0.949625970501599
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4912 M475T3172 475.100006103516 475.100006103516 475.100006103516 3172.16099774074 3172.16099774074 3172.16099774074 1 0 1 744 10.5107697488838 0.969100697119578 0.507323345952488
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4913 M475T4161 475.100006103516 475.100006103516 475.100006103516 4161.42276538468 4161.42276538468 4161.42276538468 1 1 0 6036 1.07130975220914 0.0663677719889534 0.955793486730764
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4914 M475T3497 475.200012207031 475.200012207031 475.200012207031 3496.50654000339 3496.50654000339 3496.50654000339 1 0 1 82 1.34038844806216 0.226652212094653 0.843232445981852
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4915 M475T3731 475.200012207031 475.200012207031 475.200012207031 3731.30552117362 3731.30552117362 3731.30552117362 1 1 0 84 22.9017455670193 -1.31520233116035 0.413754491899703
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4916 M475T3888 475.300018310547 475.300018310547 475.300018310547 3887.5493594461 3887.5493594461 3887.5493594461 1 0 1 2248 2.70265448553827 0.590845500702804 0.642416087940093
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4917 M475T2925 475.300018310547 475.300018310547 475.300018310547 2925.35523765682 2925.35523765682 2925.35523765682 1 0 1 2874 Inf 1 0.5
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lecorguille
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4918 M475T3046 475.300018310547 475.300018310547 475.300018310547 3045.91183806045 3045.91183806045 3045.91183806045 1 0 1 4954 Inf 1 0.5
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lecorguille
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4919 M476T3913 476 476 476 3912.78025900282 3912.78025900282 3912.78025900282 1 0 1 4842 5.12762167540712 0.790092961127095 0.566608003689738
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4920 M476T3038 476 476 476 3038.15131755569 3038.15131755569 3038.15131755569 1 0 1 3226 1.0937490078896 -0.063258974266161 0.955354493052885
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4921 M476T3310 476 476 476 3310.26484784692 3310.26484784692 3310.26484784692 1 1 0 503 Inf -1 0.5
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lecorguille
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4922 M476T3738 476 476 476 3737.84353268313 3737.84353268313 3737.84353268313 1 0 1 4718 Inf 1.1667760097421 0.451096015781379
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lecorguille
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4923 M476T2726 476 476 476 2726.48521210177 2726.48521210177 2726.48521210177 1 0 1 2509 2.78553466891231 0.60330369004936 0.637039374341676
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lecorguille
parents:
diff changeset
4924 M476T3284 476.100006103516 476.100006103516 476.100006103516 3284.41579069131 3280.23894841582 3284.9460296969 3 1 2 1226 1.02874275623354 0.0805432178339886 0.946597427083151
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4925 M476T4177 476.100006103516 476.100006103516 476.100006103516 4176.98977686189 4176.98977686189 4176.98977686189 1 1 0 4371 3.75149048009646 -2.30130758616795 0.167806862735424
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lecorguille
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diff changeset
4926 M476T3297 476.200012207031 476.200012207031 476.200012207031 3296.8379418699 3296.8379418699 3296.8379418699 1 0 1 52 2.16996391081986 1.10637938347691 0.439126562164728
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4927 M476T2684 476.200012207031 476.200012207031 476.200012207031 2684.41329800875 2684.41329800875 2684.41329800875 1 0 1 6 1.1485184901767 0.104755273495911 0.926183626244081
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4928 M476T3257 476.200012207031 476.200012207031 476.200012207031 3256.6535422177 3256.6535422177 3256.6535422177 1 0 1 34 1.35976480096939 0.280717903103336 0.810436367951789
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lecorguille
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4929 M476T2703 476.200012207031 476.200012207031 476.200012207031 2703.4024306055 2703.4024306055 2703.4024306055 1 0 1 4857 1.36649621333259 0.231494102154015 0.839733478412412
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lecorguille
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4930 M476T2742 476.200012207031 476.200012207031 476.200012207031 2742.32168716591 2742.32168716591 2742.32168716591 1 0 1 4617 1.24071445584535 0.158747830532865 0.888850115479473
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lecorguille
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diff changeset
4931 M476T4097 476.399993896484 476.399993896484 476.399993896484 4097.0970846085 4097.0970846085 4097.0970846085 1 1 0 5113 Inf -1 0.5
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lecorguille
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4932 M476T4037 476.399993896484 476.399993896484 476.399993896484 4036.91062955396 4036.91062955396 4036.91062955396 1 0 1 3772 Inf 1 0.5
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lecorguille
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4933 M477T3858 477 477 477 3857.59045806186 3857.59045806186 3857.59045806186 1 0 1 1398 Inf 1 0.5
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lecorguille
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4934 M477T2886 477 477 477 2885.95789013406 2885.95789013406 2885.95789013406 1 0 1 5657 1.71648270865728 0.397386089727578 0.734403637811456
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lecorguille
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4935 M477T3805 477 477 477 3805.49627473024 3805.49627473024 3805.49627473024 1 0 1 4184 Inf 1 0.5
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lecorguille
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diff changeset
4936 M477T3288 477.100006103516 477.100006103516 477.100006103516 3287.55118520376 3287.55118520376 3287.55118520376 1 0 1 2099 1.15052317441271 0.351347412298967 0.759692287865728
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lecorguille
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4937 M477T2545 477.100006103516 477.100006103516 477.100006103516 2544.94997459635 2544.94997459635 2544.94997459635 1 1 0 153 Inf -2.11920205595533 0.280683188259018
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lecorguille
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4938 M477T3883 477.100006103516 477.100006103516 477.100006103516 3882.81858645166 3882.81858645166 3882.81858645166 1 0 1 2249 1.01799753155104 -0.0173167121644643 0.988807578306637
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lecorguille
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4939 M477T3955 477.200012207031 477.200012207031 477.200012207031 3955.35967654843 3955.35967654843 3955.35967654843 1 0 1 5461 6.56983306182304 2.01288191038767 0.246569014404751
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lecorguille
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4940 M477T4194 477.200012207031 477.200012207031 477.200012207031 4194.40921882124 4194.40921882124 4194.40921882124 1 1 0 6167 Inf -1 0.5
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lecorguille
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4941 M477T2868 477.300018310547 477.300018310547 477.300018310547 2868.26834520196 2868.26834520196 2868.26834520196 1 1 0 3651 Inf -1 0.5
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lecorguille
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4942 M477T3516 477.300018310547 477.300018310547 477.300018310547 3515.66717457865 3515.66717457865 3515.66717457865 1 1 0 413 16.1607913245386 -2.50575844797746 0.230932456151777
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lecorguille
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diff changeset
4943 M477T3254 477.300018310547 477.300018310547 477.300018310547 3253.51430490962 3253.51430490962 3253.51430490962 1 0 1 34 Inf 1 0.5
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lecorguille
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4944 M478T2652 477.5 477.5 477.5 2651.99291442962 2651.99291442962 2651.99291442962 1 0 1 5846 Inf 1 0.5
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lecorguille
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4945 M478T3998 477.5 477.5 477.5 3998.24149106339 3998.24149106339 3998.24149106339 1 1 0 284 Inf -1 0.5
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lecorguille
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4946 M478T2990 477.899993896484 477.899993896484 477.899993896484 2990.0880290423 2990.0880290423 2990.0880290423 1 0 1 4631 1.00006692341982 -5.72076936917484e-05 0.999960500856303
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lecorguille
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4947 M478T2654 478 478 478 2654.32755137323 2654.32755137323 2654.32755137323 1 0 1 5841 1.63496263292656 0.372321805990081 0.748446026085602
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4948 M478T3706 478.100006103516 478.100006103516 478.100006103516 3706.14258814535 3706.14258814535 3706.14258814535 1 1 0 17 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
4949 M478T4205 478.100006103516 478.100006103516 478.100006103516 4204.5099086314 4204.5099086314 4204.5099086314 1 0 1 4935 9.87574011022418 0.894169394626375 0.533104498234215
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4950 M478T3981 478.100006103516 478.100006103516 478.100006103516 3981.42161936754 3981.42161936754 3981.42161936754 1 1 0 5543 Inf -1 0.5
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lecorguille
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diff changeset
4951 M478T3629 478.200012207031 478.200012207031 478.200012207031 3629.44653419444 3627.98198184035 3630.45382566854 4 2 2 [90][M]- [M-H]- 479.208 [M-H-CH2]- 493.213 26 1.09180616904434 0.197800457147195 0.874832182613315
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lecorguille
parents:
diff changeset
4952 M478T3742 478.200012207031 478.200012207031 478.200012207031 3742.33047859757 3742.33047859757 3742.33047859757 1 1 0 [M+Cl]- 443.233 14 5.28831951111247 -1.44229966352962 0.385812877929069
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lecorguille
parents:
diff changeset
4953 M478T3081 478.300018310547 478.300018310547 478.300018310547 3080.63401411864 3080.63401411864 3080.63401411864 1 1 0 3527 Inf -13.9496981174684 0.0455588793496058
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lecorguille
parents:
diff changeset
4954 M478T3677 478.300018310547 478.300018310547 478.300018310547 3677.31898979113 3677.31898979113 3677.31898979113 1 1 0 3704 3.35146353754898 -1.63680774975864 0.331159431551192
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lecorguille
parents:
diff changeset
4955 M478T2821 478.300018310547 478.300018310547 478.300018310547 2821.48052115151 2821.48052115151 2821.48052115151 1 0 1 3324 Inf 1.72008912328108 0.335247000738861
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4956 M478T2947 478.300018310547 478.300018310547 478.300018310547 2947.02000489481 2947.02000489481 2947.02000489481 1 1 0 [M-H]- 479.31 70 1.21679111453673 -0.17496964759527 0.888201703110769
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
4957 M478T3587 478.300018310547 478.300018310547 478.300018310547 3587.00409523538 3587.00409523538 3587.00409523538 1 1 0 1704 6.81822627262035 -0.844301788911865 0.548863742365474
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4958 M478T3366 478.300018310547 478.300018310547 478.300018310547 3365.7953520941 3365.7953520941 3365.7953520941 1 0 1 4662 Inf 1 0.5
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lecorguille
parents:
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4959 M478T3651 478.300018310547 478.300018310547 478.300018310547 3651.3062732892 3651.3062732892 3651.3062732892 1 1 0 24 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4960 M478T2689 478.399993896484 478.399993896484 478.399993896484 2688.93898862864 2688.93898862864 2688.93898862864 1 0 1 660 7.738647297153 0.863598030545689 0.542718545788832
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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4961 M478T3071 478.399993896484 478.399993896484 478.399993896484 3071.39529623095 3071.39529623095 3071.39529623095 1 1 0 2435 Inf -1 0.5
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lecorguille
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4962 M478T4192 478.399993896484 478.399993896484 478.399993896484 4191.87928300346 4191.87928300346 4191.87928300346 1 0 1 6168 1.53926381608952 0.293784789485894 0.800562924972909
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4963 M478T3000 478.399993896484 478.399993896484 478.399993896484 3000.40824664514 3000.40824664514 3000.40824664514 1 0 1 1822 Inf 1.44292601858552 0.385815126416808
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lecorguille
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4964 M479T2799 478.600006103516 478.600006103516 478.600006103516 2798.53883602715 2798.53883602715 2798.53883602715 1 0 1 3945 Inf 1 0.5
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lecorguille
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4965 M479T3010 478.899993896484 478.899993896484 478.899993896484 3009.90522827653 3009.90522827653 3009.90522827653 1 0 1 2085 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4966 M479T2986 478.899993896484 478.899993896484 478.899993896484 2986.14556364818 2986.14556364818 2986.14556364818 1 0 1 4632 Inf 1.62745992844696 0.350764784599991
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4967 M479T2785 478.899993896484 478.899993896484 478.899993896484 2785.03277491933 2785.03277491933 2785.03277491933 1 0 1 921 Inf 1.48178000494931 0.377933299641818
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4968 M479T3268 479 479 479 3267.51085088852 3267.51085088852 3267.51085088852 1 1 0 5474 Inf -1 0.5
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lecorguille
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4969 M479T2893 479.200012207031 479.200012207031 479.200012207031 2892.58722465327 2892.58722465327 2892.58722465327 1 1 0 95 1.54080518317951 -0.294417159326276 0.800168300826403
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lecorguille
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4970 M479T2877 479.200012207031 479.200012207031 479.200012207031 2876.53054713325 2876.53054713325 2876.53054713325 1 0 1 4738 Inf 1.42246786264732 0.390081728802884
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4971 M479T3630 479.200012207031 479.200012207031 479.200012207031 3629.74619568467 3629.74619568467 3629.74619568467 1 0 1 [90][M+1]- 26 1.02061619094569 -0.0284978730900382 0.981369263752973
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4972 M479T3414 479.300018310547 479.300018310547 479.300018310547 3414.11616186943 3414.11616186943 3414.11616186943 1 0 1 880 Inf 1 0.5
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lecorguille
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4973 M479T4088 479.399993896484 479.399993896484 479.399993896484 4087.68938648022 4087.68938648022 4087.68938648022 1 1 0 4984 1.76642539196448 -0.766088792668294 0.583647572134954
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4974 M479T3883 479.399993896484 479.399993896484 479.399993896484 3882.59075902174 3882.59075902174 3882.59075902174 1 1 0 2250 5.8484363944845 -0.817154942439401 0.557648354207581
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4975 M480T4220 479.899993896484 479.899993896484 479.899993896484 4220.29556187735 4220.29556187735 4220.29556187735 1 0 1 5331 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4976 M480T3991 480 480 480 3990.55289481131 3988.56493836266 3992.54085125997 2 1 1 [M-H-CO2]- 525.005 118 1.46662728883639 -0.262873153151729 0.820105424345822
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lecorguille
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4977 M480T3892 480 480 480 3892.28021041121 3892.28021041121 3892.28021041121 1 0 1 4907 Inf 1 0.5
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lecorguille
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4978 M480T3864 480 480 480 3863.89744476375 3863.89744476375 3863.89744476375 1 0 1 1399 Inf 1 0.5
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lecorguille
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4979 M480T4021 480 480 480 4021.34774437821 4021.34774437821 4021.34774437821 1 0 1 5580 Inf 1 0.5
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lecorguille
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4980 M480T3964 480 480 480 3963.69654968976 3963.69654968976 3963.69654968976 1 1 0 2051 Inf -1 0.5
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lecorguille
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4981 M480T4429 480.100006103516 480.100006103516 480.100006103516 4428.95540158956 4428.95540158956 4428.95540158956 1 1 0 6187 1.47158806022435 -0.303932746040299 0.790609562208304
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lecorguille
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4982 M480T3312 480.200012207031 480.200012207031 480.200012207031 3312.008768673 3305.26188051509 3318.15879926651 4 2 2 4 1.00433669981725 -0.0168241271470084 0.988326109440114
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4985 M480T2919 480.200012207031 480.200012207031 480.200012207031 2919.04838573748 2919.04838573748 2919.04838573748 1 1 0 2760 1.10111781035345 0.0954448893096546 0.932663786602633
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4986 M480T2831 480.300018310547 480.300018310547 480.300018310547 2830.85624517125 2830.85624517125 2830.85624517125 1 0 1 4583 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4987 M480T2843 480.300018310547 480.300018310547 480.300018310547 2843.31019017143 2843.31019017143 2843.31019017143 1 1 0 5527 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4988 M480T4309 480.300018310547 480.300018310547 480.300018310547 4308.77222276304 4308.77222276304 4308.77222276304 1 1 0 333 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4989 M480T3929 480.300018310547 480.300018310547 480.300018310547 3928.55077768856 3928.55077768856 3928.55077768856 1 0 1 3007 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4990 M480T3873 480.300018310547 480.300018310547 480.300018310547 3873.35730698676 3873.35730698676 3873.35730698676 1 0 1 2749 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4991 M480T3808 480.300018310547 480.300018310547 480.300018310547 3807.51847288027 3807.51847288027 3807.51847288027 1 1 0 3713 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4992 M480T4285 480.399993896484 480.399993896484 480.399993896484 4285.40874443202 4285.40874443202 4285.40874443202 1 0 1 6125 Inf 1 0.5
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lecorguille
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4993 M480T4188 480.399993896484 480.399993896484 480.399993896484 4187.94618520462 4187.94618520462 4187.94618520462 1 1 0 6065 Inf -1 0.5
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lecorguille
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4994 M481T2683 480.899993896484 480.899993896484 480.899993896484 2682.6404665213 2682.4546014594 2682.82633158321 2 1 1 661 1.87118267629095 -0.410619022122527 0.731575264268718
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lecorguille
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4995 M481T3171 480.899993896484 480.899993896484 480.899993896484 3170.77113798805 3170.77113798805 3170.77113798805 1 1 0 784 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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4996 M481T2958 480.899993896484 480.899993896484 480.899993896484 2957.50977205418 2957.50977205418 2957.50977205418 1 0 1 3271 Inf 1 0.5
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lecorguille
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4997 M481T2891 481 481 481 2891.00277522199 2891.00277522199 2891.00277522199 1 1 0 [M-H]- 482.006 95 5.45422237314446 -1.05370426401177 0.468288057625966
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lecorguille
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4998 M481T3309 481.100006103516 481.100006103516 481.100006103516 3308.58072998214 3308.58072998214 3308.58072998214 1 0 1 4 1.00754406299854 -0.0153058904147494 0.989944054793129
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lecorguille
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4999 M481T3321 481.200012207031 481.200012207031 481.200012207031 3321.03357088832 3321.03357088832 3321.03357088832 1 1 0 16 1.23429244434198 0.525543765279113 0.653066155414114
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lecorguille
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5000 M481T3298 481.200012207031 481.200012207031 481.200012207031 3297.56295880376 3297.56295880376 3297.56295880376 1 0 1 2594 1.61057682363173 0.520906084845723 0.659415083469069
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5001 M481T2867 481.200012207031 481.200012207031 481.200012207031 2867.40119261922 2867.40119261922 2867.40119261922 1 1 0 [M-H]- 482.206 [M-H-CH3]- 497.231 87 1.0507220896559 0.0695032374547963 0.955812912572608
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5002 M481T3001 481.300018310547 481.300018310547 481.300018310547 3000.96310981846 3000.96310981846 3000.96310981846 1 0 1 1842 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5003 M481T2801 481.300018310547 481.300018310547 481.300018310547 2801.06157954631 2801.06157954631 2801.06157954631 1 0 1 5176 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5004 M481T2730 481.300018310547 481.300018310547 481.300018310547 2729.94511150645 2729.94511150645 2729.94511150645 1 0 1 2457 4.06003604722089 0.91775822532731 0.506157247345808
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5005 M481T4425 481.399993896484 481.399993896484 481.399993896484 4424.68974443202 4424.68974443202 4424.68974443202 1 0 1 6213 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5006 M482T2710 481.899993896484 481.899993896484 481.899993896484 2710.03448589812 2710.03448589812 2710.03448589812 1 1 0 225 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5007 M482T3140 482 482 482 3140.04431551329 3140.04431551329 3140.04431551329 1 0 1 3121 Inf 1 0.5
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lecorguille
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5008 M482T4249 482 482 482 4249.41574443202 4249.41574443202 4249.41574443202 1 0 1 315 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5009 M482T3103 482 482 482 3102.92452396684 3102.92452396684 3102.92452396684 1 0 1 3143 1.07138646569777 0.0661303244099322 0.957719560585167
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5010 M482T4005 482 482 482 4004.52170523531 4004.52170523531 4004.52170523531 1 1 0 5819 Inf -1 0.5
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lecorguille
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diff changeset
5011 M482T3324 482.100006103516 482.100006103516 482.100006103516 3324.46362559054 3324.46362559054 3324.46362559054 1 1 0 1115 2.01866013209807 -0.948554254697823 0.490848368235311
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5012 M482T3546 482.200012207031 482.200012207031 482.200012207031 3545.92218319349 3542.48800928712 3550.02927077143 4 2 2 [91][M]- 44 1.01695671476037 -0.148898957692015 0.903562650923213
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5013 M482T3600 482.200012207031 482.200012207031 482.200012207031 3599.78903570073 3591.67067761497 3601.19076855276 4 2 2 [92][M]- [M-H-COCH2]- 525.21 22 1.1626263441469 -0.708869113786813 0.571947282500591
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5014 M482T3312 482.200012207031 482.200012207031 482.200012207031 3311.84592526338 3310.1554922049 3320.00602941677 3 1 2 4 1.07105003635071 0.845604850536561 0.544421133465005
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5015 M482T4422 482.200012207031 482.200012207031 482.200012207031 4421.55974443202 4421.55974443202 4421.55974443202 1 0 1 6197 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5016 M482T3073 482.300018310547 482.300018310547 482.300018310547 3072.81561729488 3072.81561729488 3072.81561729488 1 0 1 2436 4.40171964047652 0.753612791855354 0.579079962075375
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5017 M482T3709 482.300018310547 482.300018310547 482.300018310547 3709.21253492763 3709.21253492763 3709.21253492763 1 1 0 1189 2.38714699809633 -0.535962806284213 0.667284304230159
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5018 M482T3825 482.300018310547 482.300018310547 482.300018310547 3825.465696348 3825.465696348 3825.465696348 1 1 0 1889 24.7432605705696 -0.958802231833846 0.512971070024264
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5019 M482T3922 482.300018310547 482.300018310547 482.300018310547 3922.2425435536 3922.2425435536 3922.2425435536 1 0 1 2965 2.20519538296215 2.37863514785962 0.164883262620606
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5020 M482T3886 482.399993896484 482.399993896484 482.399993896484 3886.21079244114 3886.21079244114 3886.21079244114 1 1 0 2251 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5021 M482T3812 482.399993896484 482.399993896484 482.399993896484 3811.82763558596 3811.82763558596 3811.82763558596 1 0 1 2393 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5022 M482T2747 482.5 482.5 482.5 2746.52752074663 2746.52752074663 2746.52752074663 1 0 1 4360 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5023 M483T2913 482.899993896484 482.899993896484 482.899993896484 2912.8908895169 2912.8908895169 2912.8908895169 1 1 0 56 7.68111450549653 -0.862531623595237 0.543056356540797
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5024 M483T3119 483 483 483 3119.45337008129 3119.45337008129 3119.45337008129 1 0 1 146 3.69810871079471 0.704296408257147 0.596814151334501
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5025 M483T3515 483 483 483 3514.99046491624 3514.99046491624 3514.99046491624 1 1 0 414 Inf -1 0.5
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lecorguille
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5026 M483T3905 483.100006103516 483.100006103516 483.100006103516 3905.20958329281 3905.20958329281 3905.20958329281 1 1 0 4843 1.912732398129 0.660444303986364 0.576994859012301
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lecorguille
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5027 M483T3476 483.100006103516 483.100006103516 483.100006103516 3476.10052861681 3476.10052861681 3476.10052861681 1 0 1 1768 Inf 2.96467101632563 0.207105961009395
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lecorguille
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5028 M483T3629 483.100006103516 483.100006103516 483.100006103516 3628.9344342196 3628.9344342196 3628.9344342196 1 1 0 1621 Inf -1 0.5
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lecorguille
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5029 M483T4111 483.100006103516 483.100006103516 483.100006103516 4111.04941480277 4111.04941480277 4111.04941480277 1 1 0 43 1.05685660124643 0.042047158430747 0.970321954946148
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5030 M483T3542 483.100006103516 483.100006103516 483.100006103516 3541.9990379483 3541.9990379483 3541.9990379483 1 1 0 [93][M]- 2353 3.37899075429092 -0.737574914567703 0.594151059351033
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lecorguille
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5031 M483T3595 483.200012207031 483.200012207031 483.200012207031 3594.95380073732 3591.67067761497 3601.50136519678 5 2 2 [92][M+1]- 22 1.21086031111138 -0.944493965350315 0.513627865382752
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5032 M483T3544 483.200012207031 483.200012207031 483.200012207031 3544.07311462692 3544.07311462692 3544.07311462692 1 1 0 [91][M+1]- 44 1.04794496827274 0.137961252034191 0.909561760640436
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5033 M483T3742 483.300018310547 483.300018310547 483.300018310547 3741.62795776522 3739.17432644358 3744.08158908687 2 1 1 [M-2H+Na]- 462.312 14 3.46799540914817 -0.725938797789948 0.584658603304419
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5034 M483T3237 483.300018310547 483.300018310547 483.300018310547 3236.82694726379 3236.82694726379 3236.82694726379 1 0 1 2721 Inf 1 0.5
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lecorguille
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5035 M483T2906 483.300018310547 483.300018310547 483.300018310547 2905.83727345606 2905.83727345606 2905.83727345606 1 1 0 3931 3.76101486057489 -0.709464660939293 0.594903027195986
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5036 M483T3270 483.300018310547 483.300018310547 483.300018310547 3270.33525040543 3270.33525040543 3270.33525040543 1 1 0 5475 Inf -1 0.5
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lecorguille
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5037 M483T3636 483.300018310547 483.300018310547 483.300018310547 3635.83254947199 3635.83254947199 3635.83254947199 1 0 1 2854 Inf 1 0.5
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lecorguille
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5038 M483T3834 483.399993896484 483.399993896484 483.399993896484 3833.94247510646 3833.94247510646 3833.94247510646 1 0 1 3340 Inf 1 0.5
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lecorguille
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5039 M483T2787 483.399993896484 483.399993896484 483.399993896484 2786.52273155776 2786.52273155776 2786.52273155776 1 0 1 922 Inf 1 0.5
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lecorguille
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5040 M484T2611 483.5 483.5 483.5 2610.97128676082 2610.97128676082 2610.97128676082 1 1 0 4025 4.41647058823504 -0.754476208900922 0.578778901314113
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5041 M484T2687 483.800018310547 483.800018310547 483.800018310547 2687.30875175009 2687.30875175009 2687.30875175009 1 0 1 662 Inf 1 0.5
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lecorguille
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5042 M484T2742 483.899993896484 483.899993896484 483.899993896484 2742.15584736647 2741.99000756703 2742.32168716591 2 0 2 4603 Inf 2.4867881107585 0.243403322445362
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lecorguille
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5043 M484T2674 483.899993896484 483.899993896484 483.899993896484 2674.38567396616 2674.38567396616 2674.38567396616 1 0 1 663 6.08910111902865 1.21841900609369 0.420341010336639
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5044 M484T2779 483.899993896484 483.899993896484 483.899993896484 2779.49542059808 2779.49542059808 2779.49542059808 1 1 0 4276 Inf -1 0.5
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lecorguille
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5045 M484T2942 483.899993896484 483.899993896484 483.899993896484 2942.13826084613 2942.13826084613 2942.13826084613 1 0 1 2791 1.60532561688117 -0.374982080900605 0.770537940691141
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5046 M484T2546 483.899993896484 483.899993896484 483.899993896484 2545.94708488001 2545.94708488001 2545.94708488001 1 0 1 5165 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5047 M484T3536 484 484 484 3535.59605392345 3535.59605392345 3535.59605392345 1 1 0 1930 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5048 M484T3010 484 484 484 3009.76045391304 3009.76045391304 3009.76045391304 1 1 0 2086 Inf -2.02070434961795 0.292552742998376
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5049 M484T4206 484 484 484 4205.86975169512 4205.86975169512 4205.86975169512 1 0 1 4936 9.38401995804508 1.64802936401318 0.333412058310277
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5050 M484T2811 484 484 484 2810.65916155748 2810.65916155748 2810.65916155748 1 0 1 3321 1.34549715388317 0.701413596282024 0.604574125815171
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5051 M484T4182 484 484 484 4181.84656269688 4181.84656269688 4181.84656269688 1 1 0 6013 Inf -1.48944275900475 0.376412186092898
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5052 M484T3812 484 484 484 3812.23153189745 3812.23153189745 3812.23153189745 1 1 0 2394 1.56378590688892 -0.30373352422591 0.794379369944556
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5053 M484T3726 484 484 484 3726.1786920407 3726.1786920407 3726.1786920407 1 1 0 4681 8.96215999621414 -0.953979120317073 0.514590822219405
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5054 M484T3653 484.100006103516 484.100006103516 484.100006103516 3652.96787819215 3652.96787819215 3652.96787819215 1 0 1 2409 1.17539505709803 -0.113654641234731 0.920127500419033
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5055 M484T3544 484.100006103516 484.100006103516 484.100006103516 3543.60312635477 3543.60312635477 3543.60312635477 1 1 0 [93][M+1]- 2354 4.88389517107213 -0.779081787539592 0.570321230795339
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5056 M484T4204 484.100006103516 484.100006103516 484.100006103516 4203.83094854974 4203.83094854974 4203.83094854974 1 1 0 198 2.75624210251216 -1.21200222215948 0.349501538932149
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5057 M484T4187 484.100006103516 484.100006103516 484.100006103516 4187.31451293962 4187.31451293962 4187.31451293962 1 0 1 255 1.34212271796558 0.624569908202034 0.599315262275301
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5058 M484T3601 484.200012207031 484.200012207031 484.200012207031 3601.19076855276 3601.19076855276 3601.19076855276 1 1 0 [92][M+2]- 22 1.10889594917218 -0.458726804106008 0.693863338673766
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5059 M484T3669 484.300018310547 484.300018310547 484.300018310547 3668.80508470333 3668.80508470333 3668.80508470333 1 0 1 449 7.90614452548801 6.33527479421865 0.0564144026372611
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5060 M484T3565 484.300018310547 484.300018310547 484.300018310547 3564.72580255872 3564.72580255872 3564.72580255872 1 1 0 1627 1.84445452722545 -0.402485864626674 0.736106223238663
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5061 M484T4214 484.300018310547 484.300018310547 484.300018310547 4213.60166691331 4213.60166691331 4213.60166691331 1 0 1 5320 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5062 M484T2784 484.300018310547 484.300018310547 484.300018310547 2783.58609771271 2783.58609771271 2783.58609771271 1 1 0 12 8.60698054660457 -1.23948389294767 0.424008680588098
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5063 M484T3893 484.399993896484 484.399993896484 484.399993896484 3892.91344074546 3892.91344074546 3892.91344074546 1 0 1 4895 7.13756169170258 0.894107566351734 0.530503593127437
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5064 M484T3420 484.399993896484 484.399993896484 484.399993896484 3420.31704512667 3420.31704512667 3420.31704512667 1 0 1 881 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5065 M484T4055 484.399993896484 484.399993896484 484.399993896484 4054.68845399697 4054.68845399697 4054.68845399697 1 0 1 3431 1.74698336773143 0.423757933352952 0.742868074273785
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5066 M484T3396 484.399993896484 484.399993896484 484.399993896484 3395.5880780218 3395.5880780218 3395.5880780218 1 0 1 493 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5067 M484T3683 484.399993896484 484.399993896484 484.399993896484 3682.87772773054 3682.87772773054 3682.87772773054 1 1 0 605 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5068 M484T3931 484.399993896484 484.399993896484 484.399993896484 3930.54499932366 3930.54499932366 3930.54499932366 1 0 1 2958 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5069 M484T3041 484.5 484.5 484.5 3041.25386268849 3041.25386268849 3041.25386268849 1 0 1 3227 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5070 M484T3746 484.5 484.5 484.5 3746.37862980992 3746.37862980992 3746.37862980992 1 1 0 1068 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5071 M485T3681 484.899993896484 484.899993896484 484.899993896484 3681.31868571187 3681.31868571187 3681.31868571187 1 1 0 606 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5072 M485T3668 485 485 485 3668.40233551667 3668.40233551667 3668.40233551667 1 0 1 450 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5073 M485T3918 485 485 485 3917.51138810985 3917.51138810985 3917.51138810985 1 0 1 3008 2.94479100487453 0.625344618452585 0.627761079478139
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5074 M485T4139 485 485 485 4139.39602511555 4139.39602511555 4139.39602511555 1 1 0 4239 4.73665837202536 -0.771866645521321 0.572777614603226
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5075 M485T2903 485 485 485 2903.11197086023 2903.11197086023 2903.11197086023 1 0 1 97 2.56992368087531 1.28049069845557 0.34051421000135
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5076 M485T4132 485.100006103516 485.100006103516 485.100006103516 4131.5173144866 4131.5173144866 4131.5173144866 1 1 0 1502 4.33071136806925 -1.60836126614439 0.33830798465902
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5077 M485T2935 485.100006103516 485.100006103516 485.100006103516 2934.56017221744 2934.56017221744 2934.56017221744 1 1 0 2793 9.39787934941603 -0.967455496194528 0.507131433824081
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5078 M485T2924 485.200012207031 485.200012207031 485.200012207031 2923.6821033927 2923.6821033927 2923.6821033927 1 1 0 [M+Cl]- 450.227 60 1.7770184104221 -0.429843365786875 0.731938245295151
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5079 M485T3023 485.200012207031 485.200012207031 485.200012207031 3022.53127961302 3022.53127961302 3022.53127961302 1 0 1 [M-H]- 486.212 39 2.50643354339736 0.745732364213465 0.587397999369422
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5080 M485T3643 485.200012207031 485.200012207031 485.200012207031 3642.69637358605 3642.69637358605 3642.69637358605 1 1 0 24 5.82326500350645 -1.15939552723009 0.450927551971991
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5081 M485T2844 485.200012207031 485.200012207031 485.200012207031 2843.52301358735 2843.52301358735 2843.52301358735 1 0 1 181 1.14738079467327 0.398936328154856 0.741306347737892
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5082 M485T3132 485.300018310547 485.300018310547 485.300018310547 3132.1092416445 3132.1092416445 3132.1092416445 1 0 1 5000 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5083 M485T3044 485.300018310547 485.300018310547 485.300018310547 3044.35881367913 3044.35881367913 3044.35881367913 1 0 1 4956 3.4514987796194 2.30647873069061 0.217807751737525
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5084 M485T3771 485.300018310547 485.300018310547 485.300018310547 3770.9212916113 3770.9212916113 3770.9212916113 1 1 0 940 3.24599690024288 -2.99988643987888 0.0975907219077605
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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5085 M485T2766 485.300018310547 485.300018310547 485.300018310547 2765.83639925996 2765.83639925996 2765.83639925996 1 0 1 3807 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5086 M485T4064 485.399993896484 485.399993896484 485.399993896484 4063.82406675099 4063.82406675099 4063.82406675099 1 1 0 5799 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5087 M485T2834 485.399993896484 485.399993896484 485.399993896484 2833.76575759855 2833.76575759855 2833.76575759855 1 1 0 4584 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5088 M485T3856 485.399993896484 485.399993896484 485.399993896484 3855.84399832511 3855.84399832511 3855.84399832511 1 1 0 21 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5089 M485T2959 485.399993896484 485.399993896484 485.399993896484 2958.61214562743 2958.61214562743 2958.61214562743 1 1 0 3272 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5090 M486T3728 485.600006103516 485.600006103516 485.600006103516 3728.16712543704 3728.16712543704 3728.16712543704 1 1 0 3573 42.0619200810542 -0.97594974968214 0.507601701932444
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5091 M486T3736 485.800018310547 485.800018310547 485.800018310547 3736.28346343246 3736.28346343246 3736.28346343246 1 0 1 5199 1.61196233815759 -0.322603157434721 0.782800219352917
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5092 M486T2537 485.899993896484 485.899993896484 485.899993896484 2536.55708488001 2536.55708488001 2536.55708488001 1 0 1 5784 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5093 M486T3752 485.899993896484 485.899993896484 485.899993896484 3751.87435231748 3751.87435231748 3751.87435231748 1 0 1 14 4.98715743265915 0.783881782050814 0.568697404945114
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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5094 M486T2774 485.899993896484 485.899993896484 485.899993896484 2774.18368393945 2774.18368393945 2774.18368393945 1 1 0 5123 1.23019769689258 -0.1452015813421 0.898353100357601
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5095 M486T3726 485.899993896484 485.899993896484 485.899993896484 3726.1786920407 3726.1786920407 3726.1786920407 1 1 0 4682 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5096 M486T3726 486 486 486 3725.70378168979 3723.46990095085 3727.93766242873 2 1 1 4683 4.94420731965714 -0.910806562154187 0.516994648735314
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5097 M486T3292 486 486 486 3292.19880652399 3292.19880652399 3292.19880652399 1 0 1 5760 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5098 M486T3536 486 486 486 3536.15465906925 3536.15465906925 3536.15465906925 1 1 0 1970 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5099 M486T3948 486 486 486 3948.0247049645 3948.0247049645 3948.0247049645 1 1 0 3740 1.2623162978493 -0.211490372238683 0.852422638748337
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5100 M486T3758 486 486 486 3758.1075428284 3758.1075428284 3758.1075428284 1 0 1 934 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5101 M486T2839 486 486 486 2839.37898710014 2839.37898710014 2839.37898710014 1 1 0 4639 3.38495946078569 -0.704365310128517 0.609224667046968
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5102 M486T3654 486.100006103516 486.100006103516 486.100006103516 3654.3034227609 3654.3034227609 3654.3034227609 1 0 1 2410 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5103 M486T4226 486.100006103516 486.100006103516 486.100006103516 4225.9757971646 4225.9757971646 4225.9757971646 1 0 1 5426 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5104 M486T2831 486.100006103516 486.100006103516 486.100006103516 2830.57163018206 2830.57163018206 2830.57163018206 1 1 0 4585 1.24082306043415 -0.254737270968301 0.841191303057095
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5105 M486T3459 486.100006103516 486.100006103516 486.100006103516 3459.42839377241 3459.42839377241 3459.42839377241 1 0 1 [M+Cl+HCOOH]- 405.129 [M-H+HCOOH]- 441.106 19 1.04023105627416 0.147124103783113 0.897783574747907
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5106 M486T2799 486.200012207031 486.200012207031 486.200012207031 2799.49239024527 2798.53883602715 2800.18637367879 3 1 2 [94][M]- [M-2H+Na]- 465.229 [M-H-CH2]- 501.211 98 1.10474720721281 0.115374585497682 0.918730286039367
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5107 M486T3474 486.200012207031 486.200012207031 486.200012207031 3473.96713767892 3471.51183376243 3476.42244159541 2 0 2 [M+Cl+HCOOH]- 405.229 [M-H+HCOOH]- 441.206 [M+Cl]- 451.226 [M-H]- 487.206 31 1.11865918659911 0.367295441883813 0.748779090375963
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5108 M486T2969 486.200012207031 486.200012207031 486.200012207031 2968.87878896985 2968.87878896985 2968.87878896985 1 1 0 72 3.07195169072787 -9.96012592310603 0.0163593784602678
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5109 M486T4105 486.300018310547 486.300018310547 486.300018310547 4104.75744700432 4104.75744700432 4104.75744700432 1 1 0 192 16.7396314368317 -1.53083125177124 0.365068145125023
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5110 M486T2815 486.300018310547 486.300018310547 486.300018310547 2814.56195796808 2814.56195796808 2814.56195796808 1 1 0 3302 Inf -1.11056391382968 0.46668052010609
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5111 M486T4135 486.300018310547 486.300018310547 486.300018310547 4134.66950325724 4134.66950325724 4134.66950325724 1 1 0 3990 5.23901833057878 -4.12828053936857 0.132369124524045
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5112 M486T4095 486.399993896484 486.399993896484 486.399993896484 4094.84968717158 4091.23433688968 4098.46503745348 2 1 1 5104 2.49874259801053 -0.775760593024469 0.533737242136306
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5113 M486T3301 486.399993896484 486.399993896484 486.399993896484 3300.52179370591 3300.52179370591 3300.52179370591 1 1 0 167 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5114 M486T2872 486.399993896484 486.399993896484 486.399993896484 2872.43169931851 2872.43169931851 2872.43169931851 1 0 1 4764 5.05268723819977 1.10943559266113 0.446208787044226
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5115 M486T2649 486.399993896484 486.399993896484 486.399993896484 2648.77356750916 2648.77356750916 2648.77356750916 1 1 0 5680 3.47930639091617 -0.684860618296781 0.604120435552372
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5116 M486T2919 486.399993896484 486.399993896484 486.399993896484 2918.73532860671 2918.73532860671 2918.73532860671 1 0 1 2776 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5117 M486T3339 486.399993896484 486.399993896484 486.399993896484 3338.56144684373 3338.56144684373 3338.56144684373 1 0 1 1116 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5118 M486T3980 486.5 486.5 486.5 3979.83290448422 3979.83290448422 3979.83290448422 1 1 0 2052 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5119 M486T4010 486.5 486.5 486.5 4010.00314323252 4010.00314323252 4010.00314323252 1 1 0 5228 1.86561107454555 -0.408939758711629 0.732507277915037
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5120 M487T3757 486.800018310547 486.800018310547 486.800018310547 3756.58693534667 3756.58693534667 3756.58693534667 1 1 0 1002 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5121 M487T2553 486.800018310547 486.800018310547 486.800018310547 2553.06828676082 2553.06828676082 2553.06828676082 1 1 0 3081 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5122 M487T2758 486.800018310547 486.800018310547 486.800018310547 2758.4436988779 2758.4436988779 2758.4436988779 1 1 0 5493 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5123 M487T4212 486.800018310547 486.800018310547 486.800018310547 4212.05517447951 4212.05517447951 4212.05517447951 1 0 1 4937 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5124 M487T3529 486.899993896484 486.899993896484 486.899993896484 3529.16673849327 3529.16673849327 3529.16673849327 1 0 1 415 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5125 M487T4176 486.899993896484 486.899993896484 486.899993896484 4175.56395558154 4175.56395558154 4175.56395558154 1 1 0 4403 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5126 M487T2779 486.899993896484 486.899993896484 486.899993896484 2778.89004236641 2778.89004236641 2778.89004236641 1 1 0 4277 Inf -4.09400024046058 0.15251432517656
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5127 M487T2611 486.899993896484 486.899993896484 486.899993896484 2610.97128676082 2610.97128676082 2610.97128676082 1 1 0 4027 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5128 M487T3296 487 487 487 3296.04055494637 3296.04055494637 3296.04055494637 1 1 0 2607 7.29991590173233 -0.862274100634936 0.54659913215581
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5129 M487T3437 487 487 487 3437.02976871333 3437.02976871333 3437.02976871333 1 1 0 4883 1.63113344815476 -0.381312023277663 0.765266702630198
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5130 M487T4132 487 487 487 4131.55437805172 4131.55437805172 4131.55437805172 1 0 1 [M+Cl]- 452.027 23 Inf 2.51125298177724 0.241253583289669
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5131 M487T3802 487 487 487 3802.32909026307 3802.32909026307 3802.32909026307 1 0 1 2838 3.48009068736346 2.99289787933525 0.202603683323834
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5132 M487T3217 487.100006103516 487.100006103516 487.100006103516 3217.45538429586 3217.45538429586 3217.45538429586 2 0 1 113 2.21552785871997 0.536847029852696 0.670429748396902
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5133 M487T3682 487.100006103516 487.100006103516 487.100006103516 3681.80953790472 3681.80953790472 3681.80953790472 1 1 0 5 1.59559546772623 -0.346801960368126 0.776219696857634
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5134 M487T4173 487.100006103516 487.100006103516 487.100006103516 4172.93553468978 4172.93553468978 4172.93553468978 1 0 1 4404 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5135 M487T3238 487.100006103516 487.100006103516 487.100006103516 3238.36000103379 3238.36000103379 3238.36000103379 1 1 0 54 1.31854872799994 -0.224328308988357 0.843916734338473
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5136 M487T3496 487.200012207031 487.200012207031 487.200012207031 3496.27878193711 3496.27878193711 3496.27878193711 1 1 0 3509 2.06500658952752 -0.566868640440257 0.667675251612558
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5137 M487T2799 487.200012207031 487.200012207031 487.200012207031 2798.59668514771 2798.59668514771 2798.59668514771 1 1 0 [94][M+1]- 98 1.18359819322924 -0.180417849242963 0.874586728921182
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5138 M487T2659 487.200012207031 487.200012207031 487.200012207031 2658.87589905919 2658.87589905919 2658.87589905919 1 1 0 4052 10.3951925680136 -0.899648546319631 0.531392700578122
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5139 M487T3598 487.300018310547 487.300018310547 487.300018310547 3598.21706108862 3598.21706108862 3598.21706108862 1 0 1 1435 3.98820740563339 0.726763145631923 0.588598960071719
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5140 M487T2620 487.300018310547 487.300018310547 487.300018310547 2620.06797459635 2620.06797459635 2620.06797459635 1 1 0 2663 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5141 M487T3419 487.300018310547 487.300018310547 487.300018310547 3419.47530775973 3419.47530775973 3419.47530775973 1 1 0 882 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5142 M487T4085 487.399993896484 487.399993896484 487.399993896484 4085.03207935327 4085.03207935327 4085.03207935327 1 0 1 5728 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5143 M487T3755 487.399993896484 487.399993896484 487.399993896484 3754.99866028928 3754.99866028928 3754.99866028928 1 1 0 1069 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5144 M487T3992 487.399993896484 487.399993896484 487.399993896484 3991.69422295427 3991.69422295427 3991.69422295427 1 0 1 4503 6.90984899911611 0.846460767106037 0.548172513451769
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5145 M487T3019 487.399993896484 487.399993896484 487.399993896484 3018.94357186587 3018.94357186587 3018.94357186587 1 1 0 2124 23.474097728322 -0.95653230276964 0.51367966250939
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5146 M488T4132 487.5 487.5 487.5 4131.55437805172 4131.55437805172 4131.55437805172 1 0 1 1503 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5147 M488T3776 487.5 487.5 487.5 3776.10517790588 3776.10517790588 3776.10517790588 1 1 0 6057 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5148 M488T3848 487.5 487.5 487.5 3847.90453079719 3847.90453079719 3847.90453079719 1 1 0 1400 Inf -1.23733203235956 0.432720159590819
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5149 M488T3973 487.5 487.5 487.5 3973.47763568642 3973.47763568642 3973.47763568642 1 1 0 2053 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5150 M488T3902 487.600006103516 487.600006103516 487.600006103516 3902.04153788294 3902.04153788294 3902.04153788294 1 1 0 4844 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5151 M488T2666 487.899993896484 487.899993896484 487.899993896484 2666.35540765467 2666.35540765467 2666.35540765467 1 0 1 4069 1.31822766167107 0.192328251218591 0.866374782069088
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5152 M488T3929 488 488 488 3928.55077768856 3928.55077768856 3928.55077768856 1 0 1 3009 4.66670933652902 0.768275549566944 0.574007345672473
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5153 M488T2925 488 488 488 2925.2331000299 2925.2331000299 2925.2331000299 1 1 0 60 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5154 M488T4012 488 488 488 4011.99741513287 4011.99741513287 4011.99741513287 1 0 1 5229 1.49949116161342 -1.90998006108266 0.221012093730078
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5155 M488T3501 488.100006103516 488.100006103516 488.100006103516 3500.58472682777 3500.58472682777 3500.58472682777 1 0 1 76 1.20585414120872 0.794285053024554 0.572411912585357
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5156 M488T3984 488.100006103516 488.100006103516 488.100006103516 3983.86788889911 3983.86788889911 3983.86788889911 1 0 1 4504 2.29942519796257 1.08346565779791 0.463294390241134
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5157 M488T3616 488.100006103516 488.100006103516 488.100006103516 3616.23699063786 3616.23699063786 3616.23699063786 1 0 1 2567 1.21947460382684 0.363207492477225 0.778206495414242
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5158 M488T3774 488.100006103516 488.100006103516 488.100006103516 3773.80318790725 3773.80318790725 3773.80318790725 1 0 1 5855 1.19436204713678 -0.189047052062783 0.880401113798349
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5159 M488T2878 488.200012207031 488.200012207031 488.200012207031 2878.37908236018 2878.10295048572 2880.63943195926 3 2 1 [95][M]- 131 1.1004461120516 0.0956822568529429 0.938607661647307
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5160 M488T2889 488.300018310547 488.300018310547 488.300018310547 2888.59378202409 2888.59378202409 2888.59378202409 1 0 1 3835 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5161 M488T3733 488.300018310547 488.300018310547 488.300018310547 3733.16254816209 3733.16254816209 3733.16254816209 1 0 1 3544 2.84889755097882 -0.638772915265081 0.626786335915909
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5162 M488T2564 488.300018310547 488.300018310547 488.300018310547 2563.876668269 2563.876668269 2563.876668269 1 0 1 3082 3.87974345269905 3.02213896024106 0.096906288073741
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5163 M488T3442 488.300018310547 488.300018310547 488.300018310547 3442.18499023194 3442.18499023194 3442.18499023194 1 0 1 2917 2.37554146315785 0.533685142302978 0.668358919960283
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5164 M488T3138 488.300018310547 488.300018310547 488.300018310547 3137.91985471481 3137.91985471481 3137.91985471481 1 1 0 3122 4.72859370274578 -0.784715681270731 0.574387113916145
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5165 M488T3730 488.399993896484 488.399993896484 488.399993896484 3729.73564778711 3729.73564778711 3729.73564778711 1 1 0 [M-H]- 489.411 84 119.50872628826 -0.991597696670685 0.502667394766647
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5166 M488T2846 488.399993896484 488.399993896484 488.399993896484 2846.47495737205 2846.47495737205 2846.47495737205 1 1 0 5528 9.16126146593627 -0.885584534887115 0.535792357960309
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5167 M488T4048 488.399993896484 488.399993896484 488.399993896484 4047.7904766663 4047.7904766663 4047.7904766663 1 0 1 4121 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5168 M488T2743 488.399993896484 488.399993896484 488.399993896484 2742.70137157564 2742.70137157564 2742.70137157564 1 1 0 4618 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5169 M488T3823 488.399993896484 488.399993896484 488.399993896484 3823.22242960042 3823.22242960042 3823.22242960042 1 1 0 1890 1.38601910851717 -0.225860031615874 0.844114157008165
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5170 M489T3886 488.700012207031 488.700012207031 488.700012207031 3886.21079244114 3886.21079244114 3886.21079244114 1 1 0 2252 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5171 M489T3320 488.899993896484 488.899993896484 488.899993896484 3319.7350420509 3319.7350420509 3319.7350420509 1 1 0 1148 2.87687814394533 -0.616234049703688 0.631560440553763
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5172 M489T2787 488.899993896484 488.899993896484 488.899993896484 2786.70925520093 2786.70925520093 2786.70925520093 1 1 0 923 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5173 M489T3726 488.899993896484 488.899993896484 488.899993896484 3726.1786920407 3726.1786920407 3726.1786920407 1 1 0 4684 6.62955822427052 -0.839661870892373 0.550352703491038
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5174 M489T3520 489 489 489 3520.38334302036 3520.38334302036 3520.38334302036 1 1 0 416 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5175 M489T3744 489 489 489 3744.08158908687 3744.08158908687 3744.08158908687 1 0 1 1020 6.30497764689273 0.831007866175854 0.553142959897283
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5176 M489T2523 489 489 489 2523.187668269 2523.187668269 2523.187668269 1 0 1 5041 2.45565263657034 1.80996265059033 0.2380066244957
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5177 M489T3805 489 489 489 3805.49627473024 3805.49627473024 3805.49627473024 1 0 1 4185 2.04373736242446 0.458730819603958 0.705657980376202
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5178 M489T2697 489.100006103516 489.100006103516 489.100006103516 2697.11729136595 2697.11729136595 2697.11729136595 1 0 1 5072 10.3604197384545 1.1633988703313 0.447435969169525
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5179 M489T2892 489.100006103516 489.100006103516 489.100006103516 2891.82468804952 2891.82468804952 2891.82468804952 1 0 1 95 2.310641765123 -1.05686776063001 0.409782094365099
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5180 M489T4008 489.100006103516 489.100006103516 489.100006103516 4007.66168700858 4007.66168700858 4007.66168700858 1 1 0 5230 29.5194847092973 -0.965570194913596 0.51085562958564
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5181 M489T3823 489.100006103516 489.100006103516 489.100006103516 3823.22242960042 3823.22242960042 3823.22242960042 1 1 0 1891 3.2257387203493 -2.50787740524016 0.229326734247287
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5182 M489T3871 489.100006103516 489.100006103516 489.100006103516 3870.9333257166 3870.9333257166 3870.9333257166 1 0 1 2727 9.16694035587442 0.885658215233508 0.535769255419227
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5183 M489T2561 489.200012207031 489.200012207031 489.200012207031 2560.59997459635 2560.59997459635 2560.59997459635 1 1 0 3063 1.45848795598043 -0.646477341370298 0.622747140255453
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5184 M489T2878 489.200012207031 489.200012207031 489.200012207031 2878.10295048572 2878.10295048572 2878.10295048572 1 0 1 [95][M+1]- 131 3.18941885194893 0.937230859737762 0.519674932428044
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5185 M489T2881 489.300018310547 489.300018310547 489.300018310547 2880.63943195926 2880.63943195926 2880.63943195926 1 1 0 4739 2.02573408089744 -0.649630072416257 0.584840135853489
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5186 M489T3509 489.300018310547 489.300018310547 489.300018310547 3509.36563736658 3509.36563736658 3509.36563736658 1 1 0 4528 1.31731267258179 0.191859773665506 0.866688908898866
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5187 M489T3167 489.300018310547 489.300018310547 489.300018310547 3167.48065831574 3167.48065831574 3167.48065831574 1 0 1 785 3.00120474856312 1.8732966596531 0.268218033304952
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5188 M489T3635 489.300018310547 489.300018310547 489.300018310547 3635.03042109103 3635.03042109103 3635.03042109103 1 1 0 [M+Cl]- 454.331 59 11.3779133398654 -0.908607866980239 0.528598533206726
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5189 M489T3505 489.399993896484 489.399993896484 489.399993896484 3504.6342853155 3504.6342853155 3504.6342853155 1 1 0 3380 10.0398130206021 -1.01479806527883 0.491964333722175
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5190 M489T3682 489.399993896484 489.399993896484 489.399993896484 3681.80953790472 3681.80953790472 3681.80953790472 1 1 0 5 2.03551070144787 -0.456597471317512 0.706774696587403
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5191 M489T2715 489.399993896484 489.399993896484 489.399993896484 2715.1745643195 2715.1745643195 2715.1745643195 1 0 1 49 8.79256410744951 2.91754015006604 0.159309248586858
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5192 M489T2608 489.399993896484 489.399993896484 489.399993896484 2607.54897459635 2607.54897459635 2607.54897459635 1 1 0 4016 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5193 M490T2680 489.700012207031 489.700012207031 489.700012207031 2680.47603541585 2680.47603541585 2680.47603541585 1 1 0 664 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5194 M490T3365 489.800018310547 489.800018310547 489.800018310547 3365.06878446305 3365.06878446305 3365.06878446305 1 1 0 4663 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5195 M490T3747 489.899993896484 489.899993896484 489.899993896484 3747.07336244282 3747.07336244282 3747.07336244282 1 1 0 1070 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5196 M490T3883 489.899993896484 489.899993896484 489.899993896484 3882.81858645166 3882.81858645166 3882.81858645166 1 0 1 2253 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5197 M490T3685 490 490 490 3684.57044045452 3684.57044045452 3684.57044045452 1 0 1 607 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5198 M490T3329 490 490 490 3328.90967134892 3328.90967134892 3328.90967134892 1 1 0 1117 4.04730592052527 -2.78053636070701 0.160211411929141
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5199 M490T3697 490.100006103516 490.100006103516 490.100006103516 3697.15922176977 3697.15922176977 3697.15922176977 1 0 1 5485 Inf 4.11593613147542 0.151732010807568
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5200 M490T2878 490.100006103516 490.100006103516 490.100006103516 2878.10295048572 2878.10295048572 2878.10295048572 1 0 1 4722 1.02764755215877 0.0298991417090167 0.980624904850663
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5201 M490T3675 490.100006103516 490.100006103516 490.100006103516 3675.11742348635 3675.11742348635 3675.11742348635 1 0 1 3694 1.67365908524272 0.512230130873834 0.660540462605731
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5202 M490T3498 490.200012207031 490.200012207031 490.200012207031 3498.32889314628 3498.32889314628 3498.32889314628 1 1 0 [M+Cl]- 455.237 [M-H]- 491.21 76 3.18686450703103 -6.5312578143968 0.0226652052222076
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5203 M490T2684 490.300018310547 490.300018310547 490.300018310547 2684.41329800875 2684.41329800875 2684.41329800875 1 0 1 665 5.65972247164403 0.949746736824352 0.506074639737638
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5204 M490T3509 490.300018310547 490.300018310547 490.300018310547 3509.36563736658 3509.36563736658 3509.36563736658 1 1 0 4529 3.01854439773185 -0.63478717627895 0.623875564921066
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5205 M490T4175 490.300018310547 490.300018310547 490.300018310547 4174.94123435521 4174.94123435521 4174.94123435521 1 0 1 4405 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5206 M490T3875 490.300018310547 490.300018310547 490.300018310547 3874.75776665632 3874.75776665632 3874.75776665632 1 1 0 55 4.84580295905449 -0.818475382846437 0.557449163071736
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5207 M490T3032 490.300018310547 490.300018310547 490.300018310547 3031.96005481882 3031.96005481882 3031.96005481882 1 0 1 39 Inf 1.69798876704563 0.338835493461229
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5208 M490T3150 490.300018310547 490.300018310547 490.300018310547 3150.41272434329 3150.41272434329 3150.41272434329 1 1 0 3040 1.0572432157336 0.10461123397248 0.927770071502739
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5209 M490T2520 490.399993896484 490.399993896484 490.399993896484 2520.057668269 2520.057668269 2520.057668269 1 0 1 5054 2.03658045988617 -0.729246031169471 0.541696715247271
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5210 M490T4102 490.399993896484 490.399993896484 490.399993896484 4101.96578596283 4101.96578596283 4101.96578596283 1 0 1 5813 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5211 M490T3723 490.399993896484 490.399993896484 490.399993896484 3723.08435958574 3723.08435958574 3723.08435958574 1 1 0 3448 Inf -1.47762037426672 0.3787635535138
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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5212 M490T3016 490.399993896484 490.399993896484 490.399993896484 3016.46121097602 3016.46121097602 3016.46121097602 1 0 1 2087 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5213 M490T4067 490.399993896484 490.399993896484 490.399993896484 4066.97814594478 4066.97814594478 4066.97814594478 1 1 0 3901 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5214 M490T2867 490.399993896484 490.399993896484 490.399993896484 2867.09402266222 2867.09402266222 2867.09402266222 1 0 1 3652 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5215 M490T3801 490.5 490.5 490.5 3800.74618974528 3800.74618974528 3800.74618974528 1 0 1 2839 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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5216 M491T2788 490.600006103516 490.600006103516 490.600006103516 2788.02229392021 2788.02229392021 2788.02229392021 1 0 1 924 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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5217 M491T3208 490.899993896484 490.899993896484 490.899993896484 3208.35458973683 3208.35458973683 3208.35458973683 1 0 1 4327 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5218 M491T2934 490.899993896484 490.899993896484 490.899993896484 2934.21377019929 2934.21377019929 2934.21377019929 1 0 1 2815 1.14403606567818 0.0947930182279177 0.933257898095469
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5219 M491T3965 491 491 491 3965.0410615698 3963.24477198361 3966.837351156 2 1 1 2054 2.44258872651357 -0.54656690006187 0.662326405333928
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5220 M491T2873 491 491 491 2872.87612722882 2872.87612722882 2872.87612722882 1 1 0 4765 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5221 M491T4472 491 491 491 4472.30715089905 4472.30715089905 4472.30715089905 1 0 1 6099 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5222 M491T3104 491 491 491 3103.6991043798 3103.6991043798 3103.6991043798 1 0 1 3144 1.42450109159352 0.297350706333477 0.815671311233254
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5223 M491T3904 491 491 491 3903.6249434652 3903.6249434652 3903.6249434652 1 1 0 4845 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5224 M491T3250 491 491 491 3249.52994464377 3249.52994464377 3249.52994464377 1 1 0 1902 4.84999836771752 -1.49731900567166 0.331737132766788
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5225 M491T3923 491 491 491 3923.09007352915 3923.09007352915 3923.09007352915 1 1 0 3010 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5226 M491T3622 491 491 491 3621.75226325898 3621.75226325898 3621.75226325898 1 1 0 26 2.43237040801136 -0.54464620139307 0.663218916566981
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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5227 M491T4061 491.100006103516 491.100006103516 491.100006103516 4061.02290244779 4061.02290244779 4061.02290244779 1 1 0 4703 4.69503407101522 -0.907152081758588 0.516718859310396
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5228 M491T3829 491.200012207031 491.200012207031 491.200012207031 3828.55424806042 3824.47476800986 3832.63372811098 2 1 1 1892 3.339488380994 -15.3828255585637 0.0256956815313454
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5229 M491T3360 491.200012207031 491.200012207031 491.200012207031 3360.1798016686 3360.1798016686 3360.1798016686 1 1 0 709 24.6853350504638 -3.88197336189861 0.159872735099346
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5230 M491T3379 491.200012207031 491.200012207031 491.200012207031 3378.9382105448 3378.9382105448 3378.9382105448 1 1 0 25 21.8060140331838 -9.39302332951743 0.0675040781316074
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5231 M491T3537 491.300018310547 491.300018310547 491.300018310547 3537.48336692799 3532.96769590769 3541.9990379483 2 1 1 35 2.09924909046347 -0.507733474277473 0.688864144549592
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5232 M491T3728 491.300018310547 491.300018310547 491.300018310547 3728.16712543704 3728.16712543704 3728.16712543704 1 1 0 3574 2.06007984836812 -0.979354921346802 0.471557665414629
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5233 M491T4395 491.300018310547 491.300018310547 491.300018310547 4394.84522276304 4394.84522276304 4394.84522276304 1 1 0 6111 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5234 M491T4107 491.300018310547 491.300018310547 491.300018310547 4106.6929254971 4106.6929254971 4106.6929254971 1 0 1 43 2.44632512993546 0.64325685319001 0.628351032213386
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5235 M491T4141 491.399993896484 491.399993896484 491.399993896484 4140.86019981259 4140.86019981259 4140.86019981259 1 0 1 4240 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5236 M491T3695 491.399993896484 491.399993896484 491.399993896484 3695.39919326374 3695.39919326374 3695.39919326374 1 1 0 608 4.86597356589579 -0.77822746016218 0.570611102104654
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5237 M491T3800 491.399993896484 491.399993896484 491.399993896484 3799.66286077772 3799.66286077772 3799.66286077772 1 1 0 2840 Inf -1.58444635019197 0.358416324382023
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5238 M491T3781 491.399993896484 491.399993896484 491.399993896484 3781.48463590957 3781.48463590957 3781.48463590957 1 0 1 3678 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5239 M491T3753 491.399993896484 491.399993896484 491.399993896484 3753.4327539722 3753.4327539722 3753.4327539722 1 0 1 1071 4.84541515034323 0.777239461437452 0.570946653840769
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5240 M492T4097 491.5 491.5 491.5 4097.43616617479 4097.43616617479 4097.43616617479 1 0 1 5105 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5241 M492T3409 491.5 491.5 491.5 3409.47570356272 3409.47570356272 3409.47570356272 1 0 1 2550 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5242 M492T3538 491.899993896484 491.899993896484 491.899993896484 3537.63189084738 3537.63189084738 3537.63189084738 1 0 1 35 11.6728131108166 0.910993974237676 0.527855199356495
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5243 M492T3321 492 492 492 3321.31104390099 3321.31104390099 3321.31104390099 1 1 0 1149 Inf -3.17160190210968 0.194444035743456
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5244 M492T3466 492 492 492 3465.60554756889 3465.60554756889 3465.60554756889 1 0 1 4032 1.41857120948013 0.275975543646374 0.820424359777474
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5245 M492T2667 492 492 492 2666.99268104941 2666.99268104941 2666.99268104941 1 0 1 103 2.60305394765338 0.574874556911724 0.649451976098279
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5246 M492T3952 492.100006103516 492.100006103516 492.100006103516 3952.49471087683 3952.49471087683 3952.49471087683 1 0 1 173 2.29771134316286 0.563531523903314 0.64814039022021
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5247 M492T3600 492.100006103516 492.100006103516 492.100006103516 3599.7189016966 3599.7189016966 3599.7189016966 1 1 0 1437 2.79736392883681 -1.89977516941106 0.200949928103205
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5248 M492T3658 492.200012207031 492.200012207031 492.200012207031 3658.10741726043 3654.40667855991 3659.31435625232 3 2 1 [M+Cl]- 457.231 47 1.54297633167826 -1.92763193705653 0.303960535661438
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5249 M492T3627 492.200012207031 492.200012207031 492.200012207031 3626.73281907078 3626.73281907078 3626.73281907078 2 0 1 [M-H]- 493.213 26 1.08660581688961 -0.149462221383512 0.904149589101873
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5250 M492T3312 492.300018310547 492.300018310547 492.300018310547 3311.84592526338 3311.84592526338 3311.84592526338 1 1 0 546 6.96615793046499 -2.23500301558535 0.216883977020939
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5251 M492T3068 492.300018310547 492.300018310547 492.300018310547 3068.07361938097 3068.07361938097 3068.07361938097 1 0 1 2437 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5252 M492T3632 492.300018310547 492.300018310547 492.300018310547 3632.33489584615 3632.33489584615 3632.33489584615 1 0 1 2365 1.08911528047291 0.111437286616311 0.928123303650004
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5253 M492T3251 492.300018310547 492.300018310547 492.300018310547 3251.13198122451 3251.13198122451 3251.13198122451 1 1 0 1926 2.22303370278035 -0.526382248399248 0.68019651033485
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5254 M492T2969 492.300018310547 492.300018310547 492.300018310547 2969.47546024467 2969.47546024467 2969.47546024467 1 1 0 72 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5255 M492T2905 492.399993896484 492.399993896484 492.399993896484 2904.73772040417 2904.73772040417 2904.73772040417 1 0 1 3922 3.7173108269089 1.09539216215959 0.428890060149794
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5256 M492T3328 492.399993896484 492.399993896484 492.399993896484 3327.72543495697 3327.72543495697 3327.72543495697 1 0 1 1118 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5257 M492T3409 492.399993896484 492.399993896484 492.399993896484 3409.47570356272 3409.47570356272 3409.47570356272 1 0 1 2551 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5258 M492T2612 492.399993896484 492.399993896484 492.399993896484 2612.389668269 2612.389668269 2612.389668269 1 0 1 4017 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5259 M492T2893 492.5 492.5 492.5 2893.43940086615 2893.43940086615 2893.43940086615 1 0 1 3836 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5260 M493T2951 492.600006103516 492.600006103516 492.600006103516 2951.33707180613 2951.33707180613 2951.33707180613 1 0 1 3194 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5261 M493T2872 493 493 493 2872.43169931851 2872.43169931851 2872.43169931851 1 0 1 4766 1.95669422433079 0.483984164260184 0.710482099522581
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5262 M493T3096 493 493 493 3095.9153929194 3095.9153929194 3095.9153929194 1 1 0 5372 23.1756239453524 -1.67846662134048 0.341811465943873
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5263 M493T4147 493 493 493 4147.24214461339 4147.24214461339 4147.24214461339 1 1 0 5627 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5264 M493T3467 493 493 493 3466.92352502679 3466.92352502679 3466.92352502679 1 0 1 3107 1.46787838566551 -0.576330107943618 0.623836356756459
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5265 M493T2880 493.100006103516 493.100006103516 493.100006103516 2880.15723689098 2879.67504182271 2880.63943195926 2 1 1 131 1.34907151590874 -0.394653680818188 0.745347206052596
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5266 M493T4113 493.100006103516 493.100006103516 493.100006103516 4112.62286095321 4112.62286095321 4112.62286095321 1 1 0 [M+Cl]- 458.131 [M-H]- 494.106 43 2.92029949183991 -1.09185465777279 0.462947246520266
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5267 M493T2532 493.100006103516 493.100006103516 493.100006103516 2532.43097459635 2532.43097459635 2532.43097459635 1 1 0 5601 16.4303030303034 -1.35479034158766 0.402268657915965
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5268 M493T3028 493.100006103516 493.100006103516 493.100006103516 3028.28901291088 3028.28901291088 3028.28901291088 1 1 0 2120 3.03032696838303 -0.797527630807302 0.548474785583101
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5269 M493T3126 493.100006103516 493.100006103516 493.100006103516 3125.7752910636 3125.7752910636 3125.7752910636 1 0 1 5080 1.08713258974321 0.0759701672310712 0.94639945779638
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5270 M493T3660 493.200012207031 493.200012207031 493.200012207031 3659.65907063934 3659.65907063934 3659.65907063934 1 1 0 [M-H-NH3]- 511.23 2 3.97997892024812 -3.28112937989527 0.134897766847463
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5271 M493T4201 493.200012207031 493.200012207031 493.200012207031 4200.69027150176 4200.69027150176 4200.69027150176 1 1 0 5701 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5272 M493T3493 493.300018310547 493.300018310547 493.300018310547 3493.38039573776 3492.02433763762 3494.73645383791 2 2 0 1804 6.39847056364852 -3.0379312596413 0.108777784638231
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5273 M493T3739 493.300018310547 493.300018310547 493.300018310547 3739.40336407542 3739.40336407542 3739.40336407542 1 0 1 130 1.03643650862743 0.0526899542876306 0.966247944442648
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5274 M493T3177 493.300018310547 493.300018310547 493.300018310547 3176.86596447828 3176.86596447828 3176.86596447828 1 1 0 786 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5275 M493T2554 493.300018310547 493.300018310547 493.300018310547 2554.486668269 2554.486668269 2554.486668269 1 0 1 3083 Inf 2.66332224300442 0.228663286380181
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5276 M493T2970 493.300018310547 493.300018310547 493.300018310547 2970.31095643231 2970.31095643231 2970.31095643231 1 0 1 3273 Inf 1.49350688347252 0.375609796193781
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5277 M493T4019 493.399993896484 493.399993896484 493.399993896484 4019.05271467155 4013.17652200091 4024.92890734219 2 2 0 185 4.38276089027399 -3.3821593775716 0.182873454184147
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5278 M493T3764 493.399993896484 493.399993896484 493.399993896484 3763.5671268248 3763.5671268248 3763.5671268248 1 1 0 1003 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5279 M493T4046 493.399993896484 493.399993896484 493.399993896484 4046.4478393435 4046.4478393435 4046.4478393435 1 1 0 4122 3.24763391566392 -0.661437210557831 0.613188261519555
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5280 M493T3990 493.399993896484 493.399993896484 493.399993896484 3990.39079071013 3990.39079071013 3990.39079071013 1 1 0 4505 1.1432283799484 -0.0942991981717487 0.933602633375584
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5281 M493T2542 493.399993896484 493.399993896484 493.399993896484 2541.966668269 2541.966668269 2541.966668269 1 0 1 5549 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5282 M494T4055 493.5 493.5 493.5 4054.7467802274 4054.7467802274 4054.7467802274 1 1 0 3432 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5283 M494T3922 493.5 493.5 493.5 3922.2425435536 3922.2425435536 3922.2425435536 1 0 1 3011 Inf 1.92848272606107 0.304540581896314
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5284 M494T2718 493.600006103516 493.600006103516 493.600006103516 2718.44887166152 2718.44887166152 2718.44887166152 1 0 1 2510 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5285 M494T2925 493.800018310547 493.800018310547 493.800018310547 2924.92540780601 2924.92540780601 2924.92540780601 1 0 1 60 1.90683122083903 0.421167161411581 0.725762790841859
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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5286 M494T2930 493.899993896484 493.899993896484 493.899993896484 2929.89446868652 2929.89446868652 2929.89446868652 1 1 0 3616 5.34849122726118 -0.825427378350401 0.552794399522036
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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5287 M494T2897 494 494 494 2896.92645768053 2896.92645768053 2896.92645768053 1 0 1 3837 1.19147358425488 0.147251738521576 0.901626435551701
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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5288 M494T2525 494 494 494 2524.89828676082 2524.89828676082 2524.89828676082 1 1 0 [M-H-CO]- 523.006 5042 2.58816749549096 -1.04592720460154 0.407014682212426
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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5289 M494T3329 494 494 494 3329.10122884929 3329.10122884929 3329.10122884929 1 0 1 1086 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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5290 M494T2950 494 494 494 2949.82866539829 2949.82866539829 2949.82866539829 1 0 1 3174 1.85181466087084 -0.40474510504837 0.734843327950394
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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5291 M494T3979 494.100006103516 494.100006103516 494.100006103516 3979.40004443627 3974.68916595072 3984.11092292181 2 1 0 1984 Inf -1.34144544326837 0.407813587110231
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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5292 M494T3296 494.100006103516 494.100006103516 494.100006103516 3295.77701641459 3295.77701641459 3295.77701641459 1 1 0 2608 1.31113418665361 -0.188684971582911 0.868819841072191
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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5293 M494T3837 494.100006103516 494.100006103516 494.100006103516 3836.71587414289 3836.71587414289 3836.71587414289 1 1 0 69 Inf -1.22877168722085 0.434882382695262
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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5294 M494T3082 494.100006103516 494.100006103516 494.100006103516 3082.17471091808 3082.17471091808 3082.17471091808 1 1 0 3528 33.0363502788653 -0.969286357899648 0.509692103381545
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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5295 M494T3404 494.100006103516 494.100006103516 494.100006103516 3403.9950552722 3403.9950552722 3403.9950552722 1 0 1 1302 15.7154957763914 0.934478612615325 0.520548285767884
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5296 M494T3424 494.200012207031 494.200012207031 494.200012207031 3423.97688886272 3419.02421978847 3427.45273613588 4 2 2 [96][M]- [M-H-CH2]- 509.228 [M-H-CO]- 523.206 11 1.07082059436934 0.579137785722882 0.637012847730718
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5297 M494T4466 494.200012207031 494.200012207031 494.200012207031 4466.04715089905 4466.04715089905 4466.04715089905 1 0 1 6238 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5298 M494T2663 494.200012207031 494.200012207031 494.200012207031 2663.15465360037 2663.15465360037 2663.15465360037 1 0 1 2268 6.03220729661818 0.832551149578801 0.5571108118729
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5299 M494T3069 494.300018310547 494.300018310547 494.300018310547 3069.1084825778 3069.1084825778 3069.1084825778 1 1 0 48 2.32154834054978 0.52281335160669 0.673535787750729
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5300 M494T2868 494.300018310547 494.300018310547 494.300018310547 2868.26834520196 2868.26834520196 2868.26834520196 1 1 0 3653 2.27361050103935 -1.24223172368147 0.416646844636295
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5301 M494T2680 494.300018310547 494.300018310547 494.300018310547 2679.65826374615 2679.65826374615 2679.65826374615 1 0 1 [3M-H+Cl]2- 318.225 6 11.1184474977108 1.71654921154856 0.335480835429322
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5302 M494T4303 494.300018310547 494.300018310547 494.300018310547 4303.29215089905 4303.29215089905 4303.29215089905 1 0 1 6192 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5303 M494T3845 494.399993896484 494.399993896484 494.399993896484 3844.97719520822 3844.97719520822 3844.97719520822 1 0 1 [M+Cl]- 459.427 21 1.25981015447738 0.190963624234499 0.873637678217794
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5304 M494T2641 494.399993896484 494.399993896484 494.399993896484 2641.25838582864 2641.25838582864 2641.25838582864 1 1 0 5669 2.06103130853751 0.463166873473161 0.703345634087408
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5305 M494T2947 494.399993896484 494.399993896484 494.399993896484 2946.72109729214 2946.72109729214 2946.72109729214 1 0 1 3195 Inf 1.12418021133017 0.462825328385763
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5306 M494T4474 494.5 494.5 494.5 4473.87215089905 4473.87215089905 4473.87215089905 1 0 1 6100 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5307 M494T4133 494.5 494.5 494.5 4133.49198608082 4133.49198608082 4133.49198608082 1 0 1 [M+Cl]- 459.535 [M-H]- 495.51 99 1.17976575339913 0.116235888664515 0.918336567868171
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5308 M495T2589 494.700012207031 494.700012207031 494.700012207031 2589.06228676082 2589.06228676082 2589.06228676082 1 1 0 2901 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5309 M495T4215 494.700012207031 494.700012207031 494.700012207031 4215.14822956106 4215.14822956106 4215.14822956106 1 0 1 5332 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5310 M495T2530 494.800018310547 494.800018310547 494.800018310547 2530.29708488001 2530.29708488001 2530.29708488001 1 0 1 5612 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5311 M495T2971 494.899993896484 494.899993896484 494.899993896484 2971.02705071172 2971.02705071172 2971.02705071172 1 1 0 3238 3.12160316691338 -0.647251317222439 0.618826642129838
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5312 M495T3465 495 495 495 3465.11864061023 3465.11864061023 3465.11864061023 1 1 0 1283 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5313 M495T3357 495 495 495 3357.07936323329 3357.07936323329 3357.07936323329 1 1 0 689 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5314 M495T3514 495 495 495 3514.09305914328 3514.09305914328 3514.09305914328 1 1 0 417 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5315 M495T3887 495.100006103516 495.100006103516 495.100006103516 3887.27915673119 3887.27915673119 3887.27915673119 1 1 0 2254 3.13712081978584 -0.856926803144087 0.515197082668861
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5316 M495T3789 495.100006103516 495.100006103516 495.100006103516 3788.51932376507 3788.51932376507 3788.51932376507 1 1 0 4457 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5317 M495T3447 495.100006103516 495.100006103516 495.100006103516 3446.75991523983 3446.75991523983 3446.75991523983 1 0 1 2933 1.15892641543745 -0.103824466660173 0.926961468674463
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5318 M495T3422 495.200012207031 495.200012207031 495.200012207031 3421.79491420855 3420.60072228854 3422.98910612857 2 1 1 [96][M+1]- 11 1.17643559347131 0.538669752326263 0.672690318811942
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5319 M495T3681 495.200012207031 495.200012207031 495.200012207031 3681.42051469777 3681.42051469777 3681.42051469777 1 0 1 609 5.88530114531968 0.97199775819238 0.508929120726555
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5320 M495T3445 495.300018310547 495.300018310547 495.300018310547 3444.9796756261 3444.9796756261 3444.9796756261 1 1 0 2916 2.32089005163416 0.522677938483185 0.67360076422747
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5321 M495T2675 495.300018310547 495.300018310547 495.300018310547 2674.90732833963 2674.90732833963 2674.90732833963 1 0 1 629 Inf 15.7599939803185 0.0403405902052152
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5322 M495T3416 495.300018310547 495.300018310547 495.300018310547 3415.66499188975 3415.66499188975 3415.66499188975 1 0 1 883 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5323 M495T3851 495.300018310547 495.300018310547 495.300018310547 3851.28370176813 3851.28370176813 3851.28370176813 1 0 1 21 1.23055861191037 -0.271227621696728 0.818268633038406
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5324 M495T2738 495.300018310547 495.300018310547 495.300018310547 2737.99339739171 2737.99339739171 2737.99339739171 1 1 0 4435 1.63510771940443 -0.331362076222039 0.777493638294303
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5325 M495T4132 495.399993896484 495.399993896484 495.399993896484 4131.54356730133 4129.94151606524 4133.14561853743 2 2 0 23 3.03436658368 -1.60499915608931 0.352721665826182
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5326 M495T2818 495.399993896484 495.399993896484 495.399993896484 2817.70312026462 2817.70312026462 2817.70312026462 1 1 0 3327 1.34423393854114 0.303396418170536 0.790417724972323
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5327 M495T3918 495.399993896484 495.399993896484 495.399993896484 3918.00396721592 3918.00396721592 3918.00396721592 1 0 1 63 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5328 M495T3223 495.399993896484 495.399993896484 495.399993896484 3222.60389028255 3222.60389028255 3222.60389028255 1 0 1 4328 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5329 M495T4011 495.399993896484 495.399993896484 495.399993896484 4010.5489475845 4010.5489475845 4010.5489475845 1 0 1 5231 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5330 M495T4208 495.399993896484 495.399993896484 495.399993896484 4207.66645049006 4207.66645049006 4207.66645049006 1 0 1 4938 Inf 1.20776991891009 0.440264599651566
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5331 M495T2969 495.399993896484 495.399993896484 495.399993896484 2969.47546024467 2969.47546024467 2969.47546024467 1 1 0 72 2.01819562492638 0.452057765215303 0.709161146158044
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5332 M496T2810 495.899993896484 495.899993896484 495.899993896484 2809.76057501852 2809.76057501852 2809.76057501852 1 1 0 5749 Inf -2.52469565290488 0.24008768596272
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5333 M496T2852 496 496 496 2851.50887811 2851.50887811 2851.50887811 1 0 1 6072 1.47729391578247 0.323086162445484 0.801056127041555
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5334 M496T3917 496.100006103516 496.100006103516 496.100006103516 3916.86998621818 3916.86998621818 3916.86998621818 1 1 0 5145 1.87342797474722 -0.576362377702038 0.623438983464201
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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5335 M496T4069 496.100006103516 496.100006103516 496.100006103516 4068.55467940059 4068.55467940059 4068.55467940059 1 1 0 3853 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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5336 M496T3551 496.100006103516 496.100006103516 496.100006103516 3551.1449925006 3551.1449925006 3551.1449925006 1 0 1 2355 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5337 M496T3393 496.200012207031 496.200012207031 496.200012207031 3392.79306412581 3386.38741764506 3400.21216836929 4 2 2 [97][M]- 3 1.00422994781953 -0.0766156544925766 0.947965697976014
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
5338 M496T3332 496.200012207031 496.200012207031 496.200012207031 3331.56478201898 3330.76303444643 3332.36652959154 2 1 1 [98][M]- 15 1.03222092650553 0.584325299387034 0.653923063640945
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5339 M496T3320 496.200012207031 496.200012207031 496.200012207031 3319.53572792905 3319.45772848755 3319.61372737055 2 1 1 16 1.03182179453889 0.597205946932251 0.612093451838857
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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5340 M496T2918 496.300018310547 496.300018310547 496.300018310547 2917.50807882371 2917.50807882371 2917.50807882371 1 1 0 56 1.86224096145368 -0.459688486004658 0.723967842300447
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5341 M496T2642 496.300018310547 496.300018310547 496.300018310547 2642.46037753233 2642.46037753233 2642.46037753233 1 0 1 5670 6.96636813764371 0.847763341549929 0.54775594992316
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5342 M496T2633 496.399993896484 496.399993896484 496.399993896484 2632.9421830118 2632.9421830118 2632.9421830118 1 0 1 2632 5.77058053570827 6.65740823009704 0.0640902165617745
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5343 M496T2850 496.399993896484 496.399993896484 496.399993896484 2849.90816808503 2849.90816808503 2849.90816808503 1 0 1 5771 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5344 M496T2722 496.399993896484 496.399993896484 496.399993896484 2721.73143077261 2721.73143077261 2721.73143077261 1 1 0 2511 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5345 M497T2892 496.899993896484 496.899993896484 496.899993896484 2891.62961500899 2891.62961500899 2891.62961500899 1 1 0 3838 1.06276129959849 -0.0578575936853269 0.962647298283117
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5346 M497T2840 496.899993896484 496.899993896484 496.899993896484 2840.13625572267 2840.13625572267 2840.13625572267 1 1 0 4644 7.11548764314693 -0.851097547409433 0.54669125803647
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5347 M497T3941 497 497 497 3941.16625793116 3941.16625793116 3941.16625793116 1 0 1 4161 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5348 M497T2789 497 497 497 2789.06120506784 2789.06120506784 2789.06120506784 1 1 0 925 4.98143223096141 -0.783620995845669 0.568785420988282
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5349 M497T3974 497 497 497 3974.28264461918 3974.28264461918 3974.28264461918 1 0 1 2055 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5350 M497T3729 497.100006103516 497.100006103516 497.100006103516 3728.73148964196 3727.7273314968 3729.73564778711 2 2 0 [M-2H+Na]- 476.112 84 4.58350792750528 -0.987924337753212 0.492343021573496
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5351 M497T3352 497.100006103516 497.100006103516 497.100006103516 3352.41554007478 3352.41554007478 3352.41554007478 1 1 0 688 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5352 M497T3387 497.200012207031 497.200012207031 497.200012207031 3387.2459854539 3386.38741764506 3388.10455326274 2 1 1 [97][M+1]- 3 1.02986266395378 -0.173940511374206 0.883081218509395
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5353 M497T3331 497.200012207031 497.200012207031 497.200012207031 3330.76303444643 3319.61372737055 3332.36652959154 3 1 2 [98][M+1]- 15 1.05366493019732 1.19396670722583 0.398437433354869
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5354 M497T3400 497.200012207031 497.200012207031 497.200012207031 3400.39527472416 3399.03600389222 3401.7545455561 2 1 1 [99][M]- 20 1.00200696734273 0.0354996197234865 0.976052422544347
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5355 M497T3496 497.200012207031 497.200012207031 497.200012207031 3496.27878193711 3496.27878193711 3496.27878193711 1 1 0 3510 1.05651795902556 -0.181156511228607 0.87525520289829
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5356 M497T2791 497.200012207031 497.200012207031 497.200012207031 2791.37244185306 2791.37244185306 2791.37244185306 1 1 0 892 1.22878043003554 -0.229772309001456 0.840018687462807
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5357 M497T3682 497.300018310547 497.300018310547 497.300018310547 3681.80953790472 3681.80953790472 3681.80953790472 1 1 0 5 2.8230653302058 -0.608714048473018 0.634734387463409
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lecorguille
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5358 M497T3275 497.300018310547 497.300018310547 497.300018310547 3275.42257639745 3275.42257639745 3275.42257639745 1 1 0 145 5.97753210342634 -0.821293420614961 0.556297104659705
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5359 M497T2927 497.300018310547 497.300018310547 497.300018310547 2926.78638974879 2926.78638974879 2926.78638974879 1 1 0 2865 Inf -1.21452733824936 0.438520731216797
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lecorguille
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5360 M497T2575 497.300018310547 497.300018310547 497.300018310547 2574.830668269 2574.830668269 2574.830668269 1 0 1 4076 Inf 1 0.5
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lecorguille
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5361 M497T3961 497.399993896484 497.399993896484 497.399993896484 3960.55571047621 3960.55571047621 3960.55571047621 1 1 0 307 1.11431849596087 -0.0763531929086584 0.946160113660687
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lecorguille
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5362 M498T3109 498 498 498 3108.53493396828 3108.53493396828 3108.53493396828 1 1 0 3145 Inf -1 0.5
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lecorguille
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5363 M498T2673 498 498 498 2673.25551348623 2673.25551348623 2673.25551348623 1 1 0 4053 Inf -1 0.5
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lecorguille
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5364 M498T3503 498.100006103516 498.100006103516 498.100006103516 3502.67787245347 3502.67787245347 3502.67787245347 1 0 1 3381 1.06886923555764 0.0544258171404158 0.962323613530919
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lecorguille
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5365 M498T3400 498.200012207031 498.200012207031 498.200012207031 3399.62408613076 3399.03600389222 3400.21216836929 2 1 1 [99][M+1]- 20 1.05576469812277 1.69029014432858 0.287828496667954
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lecorguille
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5366 M498T3386 498.200012207031 498.200012207031 498.200012207031 3386.45020084445 3386.38741764506 3386.51298404383 2 1 1 [M-H]- 499.212 25 1.00983464310636 0.0437603297680301 0.969164230321748
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lecorguille
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5367 M498T3668 498.300018310547 498.300018310547 498.300018310547 3668.40233551667 3668.40233551667 3668.40233551667 1 0 1 451 4.31947940141491 0.748688895754889 0.580802670801275
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lecorguille
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5368 M498T3924 498.300018310547 498.300018310547 498.300018310547 3923.81959981163 3923.81959981163 3923.81959981163 1 0 1 [100][M]- 3012 19.0967382210209 0.952637741141216 0.515436977245984
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5369 M498T3874 498.300018310547 498.300018310547 498.300018310547 3874.075633099 3874.075633099 3874.075633099 1 0 1 [M-H-H20]- 517.328 55 Inf 1 0.5
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lecorguille
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5370 M498T4182 498.300018310547 498.300018310547 498.300018310547 4182.40649337683 4182.40649337683 4182.40649337683 1 0 1 6014 2.82858540952623 0.609498150806434 0.634401829157188
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5371 M498T3459 498.300018310547 498.300018310547 498.300018310547 3459.42839377241 3459.42839377241 3459.42839377241 1 0 1 1284 Inf 1 0.5
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lecorguille
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5372 M498T3644 498.300018310547 498.300018310547 498.300018310547 3643.53817866826 3643.53817866826 3643.53817866826 1 1 0 1542 Inf -1.36801462321055 0.401847706248917
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lecorguille
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5373 M498T4040 498.399993896484 498.399993896484 498.399993896484 4040.11823531387 4040.11823531387 4040.11823531387 1 1 0 5311 Inf -1 0.5
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lecorguille
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5374 M498T3942 498.399993896484 498.399993896484 498.399993896484 3941.5190123983 3941.5190123983 3941.5190123983 1 0 1 4162 9.52756333388637 0.890151703694607 0.534361457006467
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5375 M498T3881 498.5 498.5 498.5 3881.46684109741 3881.46684109741 3881.46684109741 1 1 0 2255 Inf -1 0.5
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lecorguille
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5376 M499T2947 498.899993896484 498.899993896484 498.899993896484 2947.37871151031 2945.46102116048 2949.29640186015 2 2 0 [M+Cl]- 463.933 70 Inf -2.95764954660258 0.207563556848835
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lecorguille
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5377 M499T2878 498.899993896484 498.899993896484 498.899993896484 2878.37908236018 2878.37908236018 2878.37908236018 1 1 0 4740 Inf -1 0.5
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lecorguille
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5378 M499T3157 499 499 499 3156.97426443286 3156.97426443286 3156.97426443286 1 1 0 840 Inf -1 0.5
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lecorguille
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5379 M499T3209 499 499 499 3208.63826237816 3208.63826237816 3208.63826237816 1 1 0 4329 1.12498514260386 -0.0830362217320941 0.941477358018382
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lecorguille
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5380 M499T4122 499 499 499 4122.06642147928 4122.06642147928 4122.06642147928 1 1 0 1741 3.12036299739936 -0.647106125117215 0.618884939833756
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lecorguille
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5381 M499T2999 499 499 499 2998.92766657837 2998.92766657837 2998.92766657837 1 1 0 [3M-H+Cl]2- 321.336 1822 1.53979366589884 -0.501243020017001 0.687320136709207
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lecorguille
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5382 M499T3899 499.100006103516 499.100006103516 499.100006103516 3899.18844899763 3899.18844899763 3899.18844899763 1 0 1 4846 Inf 1.07768005327315 0.476209217325873
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lecorguille
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5383 M499T2526 499.100006103516 499.100006103516 499.100006103516 2526.46328676082 2526.46328676082 2526.46328676082 1 1 0 5957 1.02531613679352 -0.0936478835076941 0.938495423399739
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5384 M499T4177 499.200012207031 499.200012207031 499.200012207031 4176.98977686189 4176.98977686189 4176.98977686189 1 1 0 4406 4.98554983328988 -3.46743175049488 0.170597513251742
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5385 M499T3727 499.200012207031 499.200012207031 499.200012207031 3726.59997775795 3726.59997775795 3726.59997775795 1 1 0 84 6.59470420200755 -1.02060054713589 0.491232929063694
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5386 M499T2921 499.300018310547 499.300018310547 499.300018310547 2920.88614338973 2918.39175940831 2923.38052737115 2 1 1 2875 1.95992294235019 0.744823159756152 0.536798844603096
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5387 M499T3321 499.300018310547 499.300018310547 499.300018310547 3321.19223292142 3321.19223292142 3321.19223292142 1 0 1 1131 3.85337304187951 0.716745035761366 0.592232721905598
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lecorguille
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5388 M499T3309 499.300018310547 499.300018310547 499.300018310547 3309.19933724944 3309.19933724944 3309.19933724944 1 0 1 4 4.46914604990408 0.757512052447052 0.577722732172903
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5389 M499T4100 499.300018310547 499.300018310547 499.300018310547 4100.03814060476 4100.03814060476 4100.03814060476 1 1 0 216 3.84890674472587 -0.900266788347485 0.524589685607316
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5390 M499T3453 499.300018310547 499.300018310547 499.300018310547 3453.15611017034 3453.15611017034 3453.15611017034 1 0 1 1285 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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5391 M499T3478 499.300018310547 499.300018310547 499.300018310547 3477.62927092314 3477.62927092314 3477.62927092314 1 0 1 31 6.5386916312322 1.50561472793252 0.348366535326221
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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5392 M499T3924 499.300018310547 499.300018310547 499.300018310547 3923.81959981163 3923.81959981163 3923.81959981163 1 0 1 [100][M+1]- 63 8.50821400146676 0.910528317730916 0.527657522287565
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5393 M499T3736 499.300018310547 499.300018310547 499.300018310547 3736.02301120628 3736.02301120628 3736.02301120628 1 1 0 3575 3.19326759096579 -0.888854049052205 0.510565030764648
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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5394 M499T2542 499.300018310547 499.300018310547 499.300018310547 2541.966668269 2541.966668269 2541.966668269 1 0 1 5550 Inf 28.8321678321678 0.0220713436297508
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lecorguille
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5395 M499T3476 499.399993896484 499.399993896484 499.399993896484 3476.42244159541 3476.42244159541 3476.42244159541 1 0 1 1805 Inf 1 0.5
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lecorguille
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5396 M499T3935 499.399993896484 499.399993896484 499.399993896484 3934.85902482452 3934.85902482452 3934.85902482452 1 0 1 4163 8.44404836254784 0.997530488413499 0.496078222187927
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5397 M499T4114 499.399993896484 499.399993896484 499.399993896484 4114.19641889419 4114.19641889419 4114.19641889419 1 1 0 2312 8.151431141351 -2.13875989715838 0.244965510971886
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lecorguille
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5398 M499T2594 499.399993896484 499.399993896484 499.399993896484 2594.46008488001 2594.46008488001 2594.46008488001 1 0 1 2902 Inf 1 0.5
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lecorguille
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5399 M500T2884 499.5 499.5 499.5 2883.74499442463 2883.74499442463 2883.74499442463 1 0 1 5499 Inf 1 0.5
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lecorguille
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5400 M500T2692 499.800018310547 499.800018310547 499.800018310547 2692.29815313176 2692.29815313176 2692.29815313176 1 1 0 5873 Inf -1 0.5
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lecorguille
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5401 M500T3741 499.899993896484 499.899993896484 499.899993896484 3740.75180972326 3740.75180972326 3740.75180972326 1 1 0 1072 Inf -1 0.5
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lecorguille
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5402 M500T3940 499.899993896484 499.899993896484 499.899993896484 3940.11546883793 3940.11546883793 3940.11546883793 1 1 0 4164 Inf -1 0.5
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lecorguille
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5403 M500T3853 500 500 500 3853.06616177411 3853.06616177411 3853.06616177411 1 1 0 1401 Inf -1 0.5
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lecorguille
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5404 M500T3904 500 500 500 3903.6249434652 3903.6249434652 3903.6249434652 1 1 0 4789 3.21169579855962 -1.07892275495562 0.418712376651118
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lecorguille
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5405 M500T4098 500 500 500 4098.46503745348 4098.46503745348 4098.46503745348 1 1 0 5106 10.1271210118416 -0.896893270190421 0.532253181802648
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lecorguille
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5406 M500T3614 500 500 500 3613.64356598996 3613.64356598996 3613.64356598996 1 1 0 2590 Inf -1 0.5
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5408 M500T3775 500 500 500 3775.2491776647 3775.2491776647 3775.2491776647 1 0 1 5856 3.27647161549327 0.93808040395893 0.481864896928696
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lecorguille
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5409 M500T3059 500 500 500 3058.62093932681 3058.62093932681 3058.62093932681 1 0 1 209 Inf 1 0.5
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lecorguille
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5410 M500T3531 500 500 500 3530.7343473034 3530.7343473034 3530.7343473034 1 0 1 1971 Inf 1 0.5
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lecorguille
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5411 M500T3040 500.100006103516 500.100006103516 500.100006103516 3040.17732544439 3035.99583720966 3044.35881367913 2 1 1 71 1.90309759168398 2.19383718208702 0.221932502878995
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5412 M500T2800 500.200012207031 500.200012207031 500.200012207031 2800.4363667838 2798.53883602715 2801.06157954631 4 2 2 [M+Cl]- 465.229 [M-H]- 501.211 98 1.15235506928953 -0.175002139823713 0.877486439999211
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lecorguille
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5413 M500T4185 500.200012207031 500.200012207031 500.200012207031 4184.98745239706 4184.98745239706 4184.98745239706 1 1 0 6015 1.64606618714079 -0.404952040525559 0.726298079015568
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lecorguille
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5414 M500T3938 500.200012207031 500.200012207031 500.200012207031 3938.01213952227 3938.01213952227 3938.01213952227 1 0 1 4165 4.20271278733234 0.992059081805843 0.478504714062592
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lecorguille
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5415 M500T4077 500.300018310547 500.300018310547 500.300018310547 4076.71052283205 4076.71052283205 4076.71052283205 1 1 0 3902 15.2105015414488 -5.50639821498304 0.0699103373188514
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5416 M500T2908 500.300018310547 500.300018310547 500.300018310547 2908.26668636657 2908.26668636657 2908.26668636657 1 1 0 [M+Cl]- 465.335 [M-H]- 501.31 56 1.00235061401028 -0.00166018273692094 0.998826075073417
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lecorguille
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5417 M500T2866 500.399993896484 500.399993896484 500.399993896484 2865.97703967655 2865.97703967655 2865.97703967655 1 0 1 87 Inf 14.5488966855583 0.0436885411424563
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5418 M500T3832 500.399993896484 500.399993896484 500.399993896484 3832.36574608214 3832.36574608214 3832.36574608214 1 0 1 3357 Inf 5.92126704875668 0.106509105209827
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5419 M500T4184 500.399993896484 500.399993896484 500.399993896484 4183.98525078979 4183.98525078979 4183.98525078979 1 0 1 6016 Inf 1 0.5
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lecorguille
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5420 M500T3794 500.399993896484 500.399993896484 500.399993896484 3793.96837055363 3793.96837055363 3793.96837055363 1 0 1 5406 14.1460747878433 0.92699569988847 0.522875677944752
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lecorguille
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5421 M500T4031 500.5 500.5 500.5 4030.68859222601 4030.68859222601 4030.68859222601 1 0 1 3773 Inf 1 0.5
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lecorguille
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5422 M501T3842 500.899993896484 500.899993896484 500.899993896484 3842.0543413178 3842.0543413178 3842.0543413178 1 1 0 1402 Inf -1 0.5
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lecorguille
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5423 M501T3568 500.899993896484 500.899993896484 500.899993896484 3567.75519883442 3567.75519883442 3567.75519883442 1 1 0 1678 Inf -1 0.5
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lecorguille
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5424 M501T2956 501 501 501 2956.1132744208 2956.1132744208 2956.1132744208 1 0 1 70 1.39273012936145 0.280537317198791 0.825151707168426
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lecorguille
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5425 M501T3310 501 501 501 3309.99724528819 3309.99724528819 3309.99724528819 1 1 0 547 3.29420871196166 -1.1726848406127 0.384232401458198
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lecorguille
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5426 M501T2930 501 501 501 2929.56174569858 2929.56174569858 2929.56174569858 1 0 1 3615 1.11793451945902 0.102216094322184 0.933656413412344
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lecorguille
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5427 M501T3420 501 501 501 3420.31704512667 3420.31704512667 3420.31704512667 1 0 1 884 Inf 1 0.5
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lecorguille
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5428 M501T3396 501 501 501 3395.5880780218 3395.5880780218 3395.5880780218 1 0 1 3 Inf 1 0.5
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lecorguille
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5429 M501T2797 501.100006103516 501.100006103516 501.100006103516 2797.00911516256 2797.00911516256 2797.00911516256 1 1 0 3946 Inf -1.99721536969833 0.295522180762639
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lecorguille
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5430 M501T3489 501.200012207031 501.200012207031 501.200012207031 3488.78600287563 3488.78600287563 3488.78600287563 1 0 1 31 1.1096538952414 -0.208759209419009 0.855951351937993
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lecorguille
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5431 M501T3085 501.300018310547 501.300018310547 501.300018310547 3085.25698750826 3085.25698750826 3085.25698750826 1 1 0 3529 Inf -1 0.5
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lecorguille
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5432 M501T3596 501.300018310547 501.300018310547 501.300018310547 3596.47394795055 3596.47394795055 3596.47394795055 1 1 0 1438 4.19260355053098 -1.00295755907961 0.474153376006455
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lecorguille
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5433 M501T3389 501.300018310547 501.300018310547 501.300018310547 3389.42833570345 3389.42833570345 3389.42833570345 1 0 1 494 1.38164600252133 -0.441474915972243 0.704056714626118
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lecorguille
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5434 M502T3752 501.5 501.5 501.5 3751.62921399489 3751.62921399489 3751.62921399489 1 0 1 1073 Inf 1 0.5
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lecorguille
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5435 M502T3918 501.5 501.5 501.5 3917.89401957649 3917.89401957649 3917.89401957649 1 1 0 3013 Inf -1 0.5
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lecorguille
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5436 M502T4023 501.5 501.5 501.5 4022.90524572317 4022.90524572317 4022.90524572317 1 0 1 5581 Inf 1 0.5
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lecorguille
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5437 M502T4317 502 502 502 4316.70874443202 4316.70874443202 4316.70874443202 1 0 1 345 Inf 1.46241041700769 0.381826897278902
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lecorguille
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5438 M502T3858 502 502 502 3857.79163814401 3857.79163814401 3857.79163814401 1 1 0 1403 2.88678117482073 -0.617588413138315 0.630992465732977
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lecorguille
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5439 M502T2594 502 502 502 2594.46008488001 2594.46008488001 2594.46008488001 1 0 1 61 2.61176470588246 0.750182520608108 0.586934884427916
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lecorguille
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5440 M502T4199 502 502 502 4199.11998241647 4199.11998241647 4199.11998241647 1 1 0 6084 3.44049694689967 -2.15770891698537 0.202559765785585
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lecorguille
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5441 M502T3161 502.100006103516 502.100006103516 502.100006103516 3161.39168134857 3156.6778024024 3165.48828856966 4 2 2 [101][M]- 10 1.10928484754443 0.764296224790908 0.582396706226495
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lecorguille
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5442 M502T4323 502.100006103516 502.100006103516 502.100006103516 4322.96774443202 4322.96774443202 4322.96774443202 1 0 1 349 Inf 1 0.5
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lecorguille
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5443 M502T2959 502.100006103516 502.100006103516 502.100006103516 2959.26125414707 2959.26125414707 2959.26125414707 1 0 1 3274 11.2678068205321 3.51246476567602 0.134467182127835
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5444 M502T4203 502.100006103516 502.100006103516 502.100006103516 4202.77725984139 4202.77725984139 4202.77725984139 1 0 1 5702 1.73652279532537 0.785782556614715 0.549040926798811
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5445 M502T2987 502.100006103516 502.100006103516 502.100006103516 2986.53502015473 2986.53502015473 2986.53502015473 1 1 0 4633 1.22518015802784 -0.142386071226666 0.900285695463936
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5446 M502T3026 502.200012207031 502.200012207031 502.200012207031 3026.21848381883 3024.10539557223 3028.33157206543 2 1 1 [102][M]- 39 2.44863637480947 0.761566766293708 0.580382467374662
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5447 M502T4294 502.200012207031 502.200012207031 502.200012207031 4293.90215089905 4293.90215089905 4293.90215089905 1 0 1 6144 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5448 M502T3184 502.200012207031 502.200012207031 502.200012207031 3184.44736675265 3184.44736675265 3184.44736675265 1 1 0 2166 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5449 M502T2927 502.300018310547 502.300018310547 502.300018310547 2926.78638974879 2926.78638974879 2926.78638974879 1 1 0 [M-H]- 503.312 60 3.51766904167149 -0.709704376598554 0.592416809047427
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lecorguille
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5450 M502T3888 502.399993896484 502.399993896484 502.399993896484 3887.79268385776 3887.79268385776 3887.79268385776 1 1 0 2256 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5451 M502T2923 502.399993896484 502.399993896484 502.399993896484 2923.38052737115 2923.38052737115 2923.38052737115 1 0 1 2876 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5452 M503T4184 503 503 503 4184.10786877501 4178.70541800153 4189.51031954849 2 2 0 6017 Inf -23.0772365126388 0.0275692349189105
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lecorguille
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5453 M503T2889 503 503 503 2889.41984127468 2889.41984127468 2889.41984127468 1 1 0 [M-2H+Na]- 482.029 [M-H-CH2]- 518.011 95 1.01593773641748 -0.0183978653793922 0.987107566090336
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lecorguille
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5454 M503T3666 503 503 503 3665.85204372625 3665.85204372625 3665.85204372625 1 1 0 452 2.81017819945011 -0.642964496869135 0.635588766463845
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lecorguille
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5455 M503T3161 503.100006103516 503.100006103516 503.100006103516 3160.99503573499 3156.6778024024 3163.12852685709 4 2 2 [101][M+1]- 10 1.01833261859023 -0.143734363154644 0.906637147207887
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lecorguille
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5456 M503T4056 503.100006103516 503.100006103516 503.100006103516 4056.26458848254 4056.26458848254 4056.26458848254 1 0 1 3407 6.75590406562175 1.17066422470444 0.437897114178237
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lecorguille
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5457 M503T3025 503.200012207031 503.200012207031 503.200012207031 3025.43142583923 3022.53127961302 3028.33157206543 2 1 1 [102][M+1]- 39 2.1906898270881 0.68646819530176 0.606351784289207
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lecorguille
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5458 M503T4175 503.200012207031 503.200012207031 503.200012207031 4175.42447820211 4175.42447820211 4175.42447820211 1 1 0 4372 1.15822426037212 -0.428182593321163 0.718182444422755
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5459 M503T3198 503.200012207031 503.200012207031 503.200012207031 3198.0539297914 3198.0539297914 3198.0539297914 1 1 0 1760 Inf -1 0.5
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lecorguille
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5460 M503T4205 503.300018310547 503.300018310547 503.300018310547 4205.2788573046 4203.83094854974 4206.72676605947 2 2 0 4939 2.50329533175616 -1.50216748610062 0.373387972929028
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lecorguille
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5461 M503T3524 503.300018310547 503.300018310547 503.300018310547 3524.46833803987 3524.46833803987 3524.46833803987 1 0 1 418 Inf 1 0.5
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lecorguille
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5462 M503T2527 503.300018310547 503.300018310547 503.300018310547 2527.16708488001 2527.16708488001 2527.16708488001 1 0 1 5958 1.6742081447964 0.345726268461884 0.768887472909528
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5463 M503T2855 503.300018310547 503.300018310547 503.300018310547 2854.91573801711 2854.91573801711 2854.91573801711 1 1 0 111 2.48546461364374 -0.554465681703481 0.658681478929241
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lecorguille
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5464 M503T3059 503.300018310547 503.300018310547 503.300018310547 3059.08729340991 3059.08729340991 3059.08729340991 1 1 0 5776 Inf -1 0.5
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lecorguille
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5465 M503T2715 503.399993896484 503.399993896484 503.399993896484 2715.01307286545 2711.57727406938 2718.44887166152 2 1 1 2512 1.65370355411576 -0.338260218048694 0.773345592200456
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5466 M504T2536 503.700012207031 503.700012207031 503.700012207031 2535.707668269 2535.707668269 2535.707668269 1 0 1 5785 Inf 1 0.5
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lecorguille
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5467 M504T2802 503.899993896484 503.899993896484 503.899993896484 2801.54396090667 2801.54396090667 2801.54396090667 1 0 1 5188 Inf 1 0.5
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lecorguille
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5468 M504T3954 503.899993896484 503.899993896484 503.899993896484 3954.06314819796 3954.06314819796 3954.06314819796 1 0 1 5462 Inf 1 0.5
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lecorguille
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5469 M504T3916 504 504 504 3916.43624900756 3916.43624900756 3916.43624900756 1 0 1 5146 Inf 1.35256946341765 0.405297335344753
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lecorguille
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5470 M504T4212 504 504 504 4212.40260668864 4212.40260668864 4212.40260668864 1 0 1 4940 1.35009882660122 0.238745534447034 0.84246215096217
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lecorguille
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5471 M504T2922 504 504 504 2922.13475048773 2922.13475048773 2922.13475048773 1 1 0 60 8.16152597267298 -0.876367395420526 0.541292007239872
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lecorguille
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5472 M504T3252 504.100006103516 504.100006103516 504.100006103516 3251.9444077407 3251.9444077407 3251.9444077407 1 0 1 [103][M]- [M-H-H20]- 523.128 34 1.06469515939518 0.195965159791049 0.87678009084281
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lecorguille
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5473 M504T3461 504.200012207031 504.200012207031 504.200012207031 3460.97221817713 3460.97221817713 3460.97221817713 1 0 1 1286 3.01250674777582 4.54932142002877 0.069840980484047
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lecorguille
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5474 M504T2561 504.200012207031 504.200012207031 504.200012207031 2560.89228676082 2560.89228676082 2560.89228676082 1 1 0 3084 Inf -1 0.5
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lecorguille
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5475 M504T3263 504.200012207031 504.200012207031 504.200012207031 3262.76582918442 3262.76582918442 3262.76582918442 1 1 0 3460 1.20565371005671 0.385838518339531 0.754197036566352
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5476 M504T4094 504.300018310547 504.300018310547 504.300018310547 4093.96103778435 4093.96103778435 4093.96103778435 1 1 0 5114 6.88837788315013 -5.27590910593987 0.0633303845854467
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lecorguille
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5477 M504T3731 504.300018310547 504.300018310547 504.300018310547 3730.82745447115 3730.82745447115 3730.82745447115 1 1 0 3545 6.35062431934405 -1.16660370520657 0.437253336590723
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lecorguille
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5478 M504T4223 504.300018310547 504.300018310547 504.300018310547 4223.45245550913 4223.45245550913 4223.45245550913 1 0 1 5427 5.3663362040808 1.53680474836014 0.326401668408757
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lecorguille
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5479 M504T2758 504.300018310547 504.300018310547 504.300018310547 2757.72309608863 2757.72309608863 2757.72309608863 1 0 1 244 Inf 1 0.5
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lecorguille
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5480 M504T3855 504.399993896484 504.399993896484 504.399993896484 3854.64092716079 3854.64092716079 3854.64092716079 1 1 0 1404 Inf -1 0.5
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lecorguille
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5481 M504T2747 504.399993896484 504.399993896484 504.399993896484 2746.52436743935 2746.52436743935 2746.52436743935 1 1 0 4343 Inf -2.20951412800643 0.270566065055836
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5482 M504T4224 504.399993896484 504.399993896484 504.399993896484 4223.94452658035 4223.94452658035 4223.94452658035 1 1 0 5428 Inf -1 0.5
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lecorguille
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5483 M504T3515 504.5 504.5 504.5 3514.98756952945 3510.94211515955 3519.03302389935 2 1 1 [104][M]2- 419 1.74759646063009 0.41934275594402 0.720566489695646
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lecorguille
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5484 M505T2936 504.600006103516 504.600006103516 504.600006103516 2936.11631912743 2936.11631912743 2936.11631912743 1 1 0 2798 28.005386662049 -0.963678424980774 0.511447376506398
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lecorguille
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5485 M505T4015 504.700012207031 504.700012207031 504.700012207031 4015.11576581835 4015.11576581835 4015.11576581835 1 0 1 6091 Inf 1 0.5
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lecorguille
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5486 M505T2893 504.800018310547 504.800018310547 504.800018310547 2893.20674873382 2893.20674873382 2893.20674873382 1 1 0 3839 5.02633564485639 -3.56832450187938 0.10458189851443
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5487 M505T2719 504.800018310547 504.800018310547 504.800018310547 2718.64227188502 2718.64227188502 2718.64227188502 1 1 0 2447 3.38879686297103 -0.676088129807589 0.60748201343851
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5488 M505T3528 504.899993896484 504.899993896484 504.899993896484 3527.62878275516 3527.62878275516 3527.62878275516 1 1 0 420 17.8556089269208 -0.94251822390869 0.518046782491457
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5489 M505T2897 505 505 505 2896.92645768053 2896.92645768053 2896.92645768053 1 0 1 3840 4.7209913312239 2.94234721170694 0.105991450655887
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lecorguille
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5490 M505T4105 505 505 505 4105.11785797998 4105.11785797998 4105.11785797998 1 0 1 5646 Inf 1 0.5
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lecorguille
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5491 M505T3854 505 505 505 3854.43704990612 3854.43704990612 3854.43704990612 1 0 1 1405 1.05673189387786 -0.0389941486742378 0.972446978898044
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lecorguille
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lecorguille
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5493 M505T3249 505.100006103516 505.100006103516 505.100006103516 3249.46253178708 3248.55085337842 3250.37421019573 2 1 1 [103][M+1]- 34 2.6152402664067 0.737200994422447 0.56519736503925
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lecorguille
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5494 M505T3694 505.100006103516 505.100006103516 505.100006103516 3693.91507473185 3693.91507473185 3693.91507473185 1 1 0 569 4.14184156914574 -1.39242848249338 0.392281048754104
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lecorguille
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5495 M505T3261 505.200012207031 505.200012207031 505.200012207031 3260.71953097292 3252.73571149168 3262.76582918442 5 2 2 3591 1.29976289098757 -0.586634709908155 0.644442561806264
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lecorguille
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5496 M505T3757 505.200012207031 505.200012207031 505.200012207031 3756.58693534667 3756.58693534667 3756.58693534667 1 1 0 1004 17.0445080448865 -1.12193035496278 0.463239226291726
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lecorguille
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5497 M505T3728 505.300018310547 505.300018310547 505.300018310547 3728.16712543704 3728.16712543704 3728.16712543704 1 1 0 [M-H]- 506.312 84 5.20408799343932 -0.984087844790498 0.49256637220305
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lecorguille
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5498 M505T3659 505.300018310547 505.300018310547 505.300018310547 3658.99661954341 3658.99661954341 3658.99661954341 1 0 1 [M+Cl+HCOOH]- 424.327 [M+Cl]- 470.336 [M-H]- 506.311 2 1.10754841358515 0.423633221865439 0.727606291130098
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lecorguille
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5499 M505T3739 505.399993896484 505.399993896484 505.399993896484 3739.17432644358 3739.17432644358 3739.17432644358 1 1 0 130 2.33005591779339 -0.524557092204177 0.67270016567202
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lecorguille
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5500 M505T3910 505.399993896484 505.399993896484 505.399993896484 3910.16592439504 3910.16592439504 3910.16592439504 1 0 1 4847 3.88768872532427 0.719361236347361 0.591279281727889
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lecorguille
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5501 M505T3987 505.399993896484 505.399993896484 505.399993896484 3986.89802514914 3986.89802514914 3986.89802514914 1 0 1 4506 1.11466356719435 0.0765705305591753 0.946007715394081
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lecorguille
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5502 M506T2537 505.5 505.5 505.5 2537.271668269 2537.271668269 2537.271668269 1 0 1 5913 Inf 1 0.5
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lecorguille
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5503 M506T3998 505.5 505.5 505.5 3997.94800745092 3997.94800745092 3997.94800745092 1 0 1 6156 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5504 M506T4150 505.5 505.5 505.5 4150.16595534487 4150.16595534487 4150.16595534487 1 0 1 6045 Inf 1 0.5
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lecorguille
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5505 M506T2717 505.600006103516 505.600006103516 505.600006103516 2716.8143906957 2716.8143906957 2716.8143906957 1 0 1 2513 Inf 1 0.5
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lecorguille
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5506 M506T2736 505.700012207031 505.700012207031 505.700012207031 2735.65452398377 2735.65452398377 2735.65452398377 1 1 0 2514 Inf -1 0.5
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lecorguille
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5507 M506T2994 505.800018310547 505.800018310547 505.800018310547 2993.74761787269 2988.08491011124 2999.41032563414 2 1 1 1843 1.49268372365781 -0.440965697595974 0.70234575172437
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5508 M506T2776 505.899993896484 505.899993896484 505.899993896484 2776.14664739547 2776.14664739547 2776.14664739547 1 0 1 5124 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5509 M506T4130 505.899993896484 505.899993896484 505.899993896484 4130.01232811671 4130.01232811671 4130.01232811671 1 1 0 1504 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
5510 M506T3956 506 506 506 3955.84913291293 3955.84913291293 3955.84913291293 1 1 0 173 4.21972349100746 -0.742454073398652 0.582998494465695
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lecorguille
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5511 M506T3210 506 506 506 3209.92216100591 3209.92216100591 3209.92216100591 1 1 0 4330 17.712333899212 -0.942041987613348 0.518195015202066
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lecorguille
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5512 M506T4079 506 506 506 4078.8300086693 4078.8300086693 4078.8300086693 1 0 1 3903 Inf 1 0.5
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lecorguille
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5513 M506T3256 506.100006103516 506.100006103516 506.100006103516 3256.43182590051 3256.43182590051 3256.43182590051 1 1 0 [103][M+2]- 34 1.04203865556938 0.184192813062375 0.87221374704239
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lecorguille
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5514 M506T3382 506.100006103516 506.100006103516 506.100006103516 3382.01892208389 3382.01892208389 3382.01892208389 1 1 0 1582 1.70041527492564 0.699789491309276 0.610951413254734
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5515 M506T3391 506.200012207031 506.200012207031 506.200012207031 3391.28138569657 3378.68960817281 3394.04760467768 3 2 1 3 1.18950220562952 1.48928948100055 0.361255382439873
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lecorguille
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5516 M506T4181 506.200012207031 506.200012207031 506.200012207031 4180.82775880486 4180.82775880486 4180.82775880486 1 0 1 5992 3.76859282787642 5.14189784497321 0.0402960134904846
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lecorguille
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5517 M506T3306 506.300018310547 506.300018310547 506.300018310547 3306.27819255277 3300.71045984215 3311.84592526338 2 1 1 548 3.57518043214177 0.762927031437376 0.581785456362296
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lecorguille
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5518 M506T3332 506.300018310547 506.300018310547 506.300018310547 3332.3332359794 3332.3332359794 3332.3332359794 1 1 0 1119 1.71540933918176 -0.545643405987228 0.641314290266673
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lecorguille
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5519 M506T2583 506.399993896484 506.399993896484 506.399993896484 2582.50897459635 2582.50897459635 2582.50897459635 1 1 0 5689 Inf -1 0.5
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lecorguille
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5520 M506T2567 506.5 506.5 506.5 2567.15228676082 2567.15228676082 2567.15228676082 1 1 0 5862 Inf -1 0.5
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lecorguille
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5521 M507T2710 506.600006103516 506.600006103516 506.600006103516 2710.03448589812 2710.03448589812 2710.03448589812 1 1 0 225 Inf -1 0.5
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lecorguille
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5522 M507T3732 507 507 507 3731.60167054542 3731.60167054542 3731.60167054542 1 0 1 3576 2.39127020664762 0.536767097671278 0.666905656081132
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lecorguille
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5523 M507T3177 507 507 507 3176.84183328914 3176.84183328914 3176.84183328914 1 0 1 787 Inf 1.47664184312192 0.378959332484944
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lecorguille
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5524 M507T3650 507.100006103516 507.100006103516 507.100006103516 3649.79336627557 3649.79336627557 3649.79336627557 1 0 1 1543 Inf 1 0.5
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lecorguille
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5525 M507T3430 507.100006103516 507.100006103516 507.100006103516 3429.66746677901 3429.66746677901 3429.66746677901 1 0 1 5270 1.08639369803962 -0.0820111358846039 0.946015665251724
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5526 M507T3399 507.100006103516 507.100006103516 507.100006103516 3399.03600389222 3399.03600389222 3399.03600389222 1 1 0 1329 Inf -1 0.5
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lecorguille
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5527 M507T3382 507.100006103516 507.100006103516 507.100006103516 3381.73449888661 3381.73449888661 3381.73449888661 1 0 1 1583 Inf 1 0.5
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lecorguille
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5528 M507T3383 507.200012207031 507.200012207031 507.200012207031 3383.41946422924 3381.73613007318 3385.10279838529 2 1 1 [M+Cl]- 472.228 25 1.25071953824529 0.932210017651654 0.450002914658453
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lecorguille
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5529 M507T3024 507.200012207031 507.200012207031 507.200012207031 3023.8682802123 3022.53127961302 3025.20528081158 2 1 1 [M-2H+Na]- 486.212 39 2.68630970398185 0.731816138495107 0.59646434213472
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lecorguille
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5530 M507T3113 507.300018310547 507.300018310547 507.300018310547 3113.0638271742 3113.0638271742 3113.0638271742 1 1 0 5350 1.53027752254137 -0.290078997581321 0.80287975001672
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lecorguille
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5531 M507T3304 507.300018310547 507.300018310547 507.300018310547 3303.94373016607 3303.94373016607 3303.94373016607 1 1 0 5390 1.14394823375672 -0.318180861917593 0.78222134116243
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lecorguille
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5532 M507T4176 507.300018310547 507.300018310547 507.300018310547 4176.48836940693 4176.48836940693 4176.48836940693 1 0 1 4407 2.72300551223312 0.593971798292043 0.641057716477158
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lecorguille
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5533 M507T2575 507.300018310547 507.300018310547 507.300018310547 2574.830668269 2574.830668269 2574.830668269 1 0 1 4077 1.68938807126259 0.351160859330475 0.76566316869349
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lecorguille
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5534 M507T2793 507.300018310547 507.300018310547 507.300018310547 2793.16296782797 2793.16296782797 2793.16296782797 1 0 1 901 1.00974667381988 0.00685843464291123 0.995150463260198
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lecorguille
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5535 M507T3635 507.300018310547 507.300018310547 507.300018310547 3635.03042109103 3635.03042109103 3635.03042109103 1 1 0 2846 10.1999282444467 -2.7687188128325 0.220321038707886
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5536 M507T2725 507.399993896484 507.399993896484 507.399993896484 2724.89514086813 2724.89514086813 2724.89514086813 1 0 1 2515 1.71440071594915 0.402740019928813 0.749569311189823
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5537 M507T3659 507.399993896484 507.399993896484 507.399993896484 3658.99661954341 3658.99661954341 3658.99661954341 1 0 1 453 Inf 1 0.5
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lecorguille
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5538 M508T2641 507.5 507.5 507.5 2640.87339496389 2640.87339496389 2640.87339496389 1 0 1 5671 Inf 1 0.5
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5539 M508T2700 507.800018310547 507.800018310547 507.800018310547 2700.3977849365 2700.3977849365 2700.3977849365 1 0 1 4871 Inf 1 0.5
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5540 M508T2605 507.899993896484 507.899993896484 507.899993896484 2604.71128676082 2604.71128676082 2604.71128676082 1 1 0 5240 3.16583333333335 -0.652356457977041 0.616784459383281
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5541 M508T2936 508 508 508 2936.11631912743 2936.11631912743 2936.11631912743 1 1 0 2797 1.18737701078816 -0.120703544774771 0.915240468623886
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5542 M508T4176 508 508 508 4176.09171998227 4176.09171998227 4176.09171998227 1 0 1 [105][M]- 4408 2.39227019281294 0.704661544376249 0.568626441717607
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5543 M508T4400 508 508 508 4400.31915089905 4400.31915089905 4400.31915089905 1 0 1 6227 6.02970297029679 2.02969557399937 0.234207194914436
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5544 M508T4382 508 508 508 4382.32522276304 4382.32522276304 4382.32522276304 1 1 0 301 7.25567466309121 -0.854103062727487 0.545733424656016
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lecorguille
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lecorguille
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5546 M508T2966 508 508 508 2966.37191352751 2966.37191352751 2966.37191352751 1 1 0 3239 Inf -1 0.5
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lecorguille
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5547 M508T3309 508.100006103516 508.100006103516 508.100006103516 3309.19933724944 3309.19933724944 3309.19933724944 1 0 1 549 3.15850342407267 0.651520141437899 0.617117992454793
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lecorguille
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5548 M508T3037 508.100006103516 508.100006103516 508.100006103516 3036.66497408795 3036.66497408795 3036.66497408795 1 0 1 71 2.33968460313058 0.893983101100318 0.531410188876487
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lecorguille
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lecorguille
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5550 M508T3403 508.100006103516 508.100006103516 508.100006103516 3403.29749142804 3403.29749142804 3403.29749142804 1 0 1 1330 1.50453034909965 0.320912234633904 0.795691056759267
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5551 M508T3522 508.200012207031 508.200012207031 508.200012207031 3521.72322040921 3518.81181544796 3524.45539948538 4 2 2 [106][M]- 1 1.11662843678351 2.58001225952289 0.141994468967057
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lecorguille
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lecorguille
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5553 M508T3840 508.300018310547 508.300018310547 508.300018310547 3840.46492561855 3838.31981910429 3842.6100321328 2 1 1 [107][M]- 69 9.96504941014658 -0.903422290228517 0.530545425138747
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lecorguille
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5554 M508T2533 508.300018310547 508.300018310547 508.300018310547 2532.72328676082 2532.72328676082 2532.72328676082 1 1 0 5602 1.48222501045584 -0.616888011570864 0.637932994035771
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lecorguille
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5555 M508T3105 508.300018310547 508.300018310547 508.300018310547 3105.38177767139 3105.38177767139 3105.38177767139 1 1 0 3146 8.37889523700619 -3.90208997432513 0.0789884626782731
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lecorguille
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5556 M508T3913 508.300018310547 508.300018310547 508.300018310547 3913.30169008989 3913.30169008989 3913.30169008989 1 0 1 5147 2.33066487618143 0.570560979899339 0.669715831501785
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lecorguille
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5557 M508T4165 508.300018310547 508.300018310547 508.300018310547 4165.04329049758 4165.04329049758 4165.04329049758 1 0 1 6158 1.42817749662902 -0.401092722063045 0.7452390471751
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lecorguille
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5558 M508T2986 508.300018310547 508.300018310547 508.300018310547 2986.08277860764 2986.08277860764 2986.08277860764 1 1 0 4623 3.69219816553721 -0.703801714692814 0.596997764794374
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lecorguille
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5559 M508T4415 508.300018310547 508.300018310547 508.300018310547 4415.30074443202 4415.30074443202 4415.30074443202 1 0 1 6121 Inf 1 0.5
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lecorguille
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5560 M508T3981 508.300018310547 508.300018310547 508.300018310547 3981.42161936754 3981.42161936754 3981.42161936754 1 1 0 5544 4.7361870717137 -0.771842812583979 0.572785760066072
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lecorguille
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5561 M508T4035 508.300018310547 508.300018310547 508.300018310547 4035.36930491244 4035.36930491244 4035.36930491244 1 1 0 3774 1.44200940702115 -0.596025112054432 0.630823667472001
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lecorguille
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5562 M508T4398 508.399993896484 508.399993896484 508.399993896484 4398.08574443202 4398.08574443202 4398.08574443202 2 0 1 6112 Inf 1.27996906419181 0.422215602866012
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lecorguille
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5563 M508T4367 508.399993896484 508.399993896484 508.399993896484 4366.67622276304 4366.67622276304 4366.67622276304 1 1 0 6233 Inf -1.75856497334899 0.329161430685806
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lecorguille
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5564 M508T4216 508.399993896484 508.399993896484 508.399993896484 4215.55989845916 4215.55989845916 4215.55989845916 1 0 1 5333 5.89070036613767 0.818530401272437 0.55719873719912
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lecorguille
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5565 M508T4400 508.5 508.5 508.5 4400.31915089905 4400.31915089905 4400.31915089905 1 0 1 6228 Inf 1 0.5
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lecorguille
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5566 M509T3309 508.899993896484 508.899993896484 508.899993896484 3308.58072998214 3308.58072998214 3308.58072998214 1 0 1 550 Inf 1 0.5
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lecorguille
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5567 M509T2898 509 509 509 2897.94212950607 2897.94212950607 2897.94212950607 1 1 0 134 3.86501448116276 -1.08449382929641 0.473340812996031
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lecorguille
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5568 M509T4144 509 509 509 4143.9632134336 4143.9632134336 4143.9632134336 1 0 1 219 Inf 1 0.5
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lecorguille
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5569 M509T4171 509 509 509 4171.35699561709 4171.35699561709 4171.35699561709 1 0 1 [105][M+1]- 4409 5.83894109414264 1.59641850724016 0.353753129320167
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lecorguille
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5570 M509T4378 509 509 509 4378.40915089905 4378.40915089905 4378.40915089905 1 0 1 6217 2.37223370619958 0.533032208173613 0.668667612793862
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lecorguille
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5571 M509T3483 509.100006103516 509.100006103516 509.100006103516 3482.55403739929 3482.55403739929 3482.55403739929 1 1 0 31 1.64402546528444 0.334685390699327 0.775491778746058
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5572 M509T4201 509.100006103516 509.100006103516 509.100006103516 4201.35229340183 4201.35229340183 4201.35229340183 1 0 1 5703 1.53154905299301 0.341897615912751 0.787704476458722
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5573 M509T3154 509.100006103516 509.100006103516 509.100006103516 3154.35707626388 3154.35707626388 3154.35707626388 1 0 1 5903 1.13866418007347 -0.203990480805781 0.862034414529194
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5574 M509T3522 509.200012207031 509.200012207031 509.200012207031 3521.72322040921 3515.66717457865 3526.04104000459 4 2 2 [106][M+1]- 1 1.10717316385488 3.22812479278821 0.129099748671569
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5575 M509T4354 509.200012207031 509.200012207031 509.200012207031 4354.26674443202 4354.26674443202 4354.26674443202 1 0 1 343 Inf 1 0.5
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lecorguille
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5576 M509T4380 509.300018310547 509.300018310547 509.300018310547 4379.97415089905 4379.97415089905 4379.97415089905 1 0 1 298 Inf 1 0.5
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lecorguille
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5577 M509T3838 509.300018310547 509.300018310547 509.300018310547 3838.31981910429 3838.31981910429 3838.31981910429 1 1 0 [107][M+1]- 69 6.60975379296923 -0.841464842873507 0.550841177888082
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lecorguille
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5578 M509T4351 509.300018310547 509.300018310547 509.300018310547 4350.70840158956 4350.70840158956 4350.70840158956 1 1 0 6201 1.50704346285563 -0.280345098128929 0.808999555106011
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5579 M509T3945 509.399993896484 509.399993896484 509.399993896484 3944.65484991612 3944.65484991612 3944.65484991612 1 0 1 3744 Inf 1 0.5
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lecorguille
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5580 M509T3157 509.399993896484 509.399993896484 509.399993896484 3156.55916540663 3156.55916540663 3156.55916540663 1 0 1 841 Inf 1 0.5
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lecorguille
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5581 M509T2823 509.399993896484 509.399993896484 509.399993896484 2823.0524476356 2823.0524476356 2823.0524476356 1 0 1 3303 Inf 1 0.5
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lecorguille
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5582 M509T2616 509.399993896484 509.399993896484 509.399993896484 2615.519668269 2615.519668269 2615.519668269 1 0 1 5638 Inf 1.48326711989989 0.377637251001013
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lecorguille
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5583 M509T2843 509.399993896484 509.399993896484 509.399993896484 2843.49650897793 2843.49650897793 2843.49650897793 1 0 1 5524 1.73583103578673 0.367314102512832 0.756184694986646
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lecorguille
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5584 M510T2603 509.5 509.5 509.5 2603.14628676082 2603.14628676082 2603.14628676082 1 1 0 5247 Inf -1 0.5
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lecorguille
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5585 M510T3031 509.800018310547 509.800018310547 509.800018310547 3031.372545276 3031.372545276 3031.372545276 1 1 0 2153 Inf -1 0.5
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lecorguille
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5586 M510T2702 509.899993896484 509.899993896484 509.899993896484 2701.64547937692 2701.64547937692 2701.64547937692 1 1 0 4872 2.27776529279933 -0.513651309786131 0.677959701602325
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lecorguille
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5587 M510T2881 510 510 510 2881.24660857796 2881.24660857796 2881.24660857796 1 0 1 131 Inf 1 0.5
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lecorguille
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5588 M510T4006 510 510 510 4005.75675132357 4005.75675132357 4005.75675132357 1 0 1 6127 Inf 1 0.5
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lecorguille
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5589 M510T4475 510 510 510 4474.65822276304 4474.65822276304 4474.65822276304 1 1 0 300 Inf -1 0.5
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lecorguille
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lecorguille
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5591 M510T3464 510.100006103516 510.100006103516 510.100006103516 3464.06082661751 3457.15654781979 3469.98237434041 3 1 2 19 1.32684196939209 0.647254535899316 0.599606208305208
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5592 M510T4126 510.100006103516 510.100006103516 510.100006103516 4126.24828874772 4125.3114579078 4127.18511958764 2 1 1 1505 2.12730805332907 -0.897138740482794 0.530290253502246
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5593 M510T4097 510.100006103516 510.100006103516 510.100006103516 4097.23784360811 4097.23784360811 4097.23784360811 1 0 1 5107 Inf 1 0.5
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lecorguille
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5594 M510T3932 510.100006103516 510.100006103516 510.100006103516 3932.11262756656 3932.11262756656 3932.11262756656 1 0 1 2942 8.52891560761588 1.30646610950469 0.406331808303923
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lecorguille
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5595 M510T4184 510.100006103516 510.100006103516 510.100006103516 4183.98525078979 4183.98525078979 4183.98525078979 1 0 1 6018 2.02903360815544 0.505027629779171 0.701157283065631
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lecorguille
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5596 M510T3531 510.200012207031 510.200012207031 510.200012207031 3530.7343473034 3523.66846363941 3538.79470195538 5 2 2 [108][M]- 35 1.02311173775615 3.21315777042036 0.156971797560875
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lecorguille
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5597 M510T3764 510.200012207031 510.200012207031 510.200012207031 3764.42385517246 3762.94929187377 3765.89841847115 2 1 1 [109][M]- 13 1.55165661300885 0.430522788795729 0.717964125727121
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lecorguille
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5598 M510T3748 510.200012207031 510.200012207031 510.200012207031 3748.18071482581 3745.30239044737 3751.05903920425 2 1 1 [110][M]- 1034 1.48478616381006 0.401713940910226 0.73409762051202
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lecorguille
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5599 M510T4479 510.200012207031 510.200012207031 510.200012207031 4478.56615089905 4478.56615089905 4478.56615089905 1 0 1 6117 7.4363417317952 0.857803998278854 0.544556342822482
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lecorguille
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5600 M510T3722 510.300018310547 510.300018310547 510.300018310547 3722.22952980018 3718.49152830969 3734.44922651774 3 1 2 3449 2.06450884620194 -0.658008129573596 0.629292731708948
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lecorguille
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5601 M510T2712 510.300018310547 510.300018310547 510.300018310547 2712.46713466996 2712.46713466996 2712.46713466996 1 1 0 2516 2.42460867956761 -0.543177211573942 0.663903167942007
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lecorguille
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5602 M510T3842 510.300018310547 510.300018310547 510.300018310547 3841.52198953037 3841.52198953037 3841.52198953037 1 1 0 [111][M]- 1342 9.51843337226149 -0.943706988367111 0.515355364074701
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lecorguille
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5603 M510T3302 510.300018310547 510.300018310547 510.300018310547 3302.10240780312 3302.10240780312 3302.10240780312 1 1 0 167 1.59222900677298 0.431070479614038 0.708562946003416
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lecorguille
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5604 M510T3052 510.300018310547 510.300018310547 510.300018310547 3051.8278523358 3051.8278523358 3051.8278523358 1 1 0 3474 5.73130684299586 -1.23393912131289 0.413127624736336
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5630 M511T3689 511.399993896484 511.399993896484 511.399993896484 3688.74650410743 3688.74650410743 3688.74650410743 1 0 1 610 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5631 M511T3440 511.399993896484 511.399993896484 511.399993896484 3440.21498381355 3440.21498381355 3440.21498381355 1 1 0 62 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5632 M511T3114 511.399993896484 511.399993896484 511.399993896484 3114.02104468809 3114.02104468809 3114.02104468809 1 0 1 5976 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5633 M511T2761 511.399993896484 511.399993896484 511.399993896484 2761.41308680454 2761.41308680454 2761.41308680454 1 0 1 3819 1.95899921922275 1.44700862682846 0.32867729952582
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5634 M512T3202 511.5 511.5 511.5 3202.07373018462 3202.07373018462 3202.07373018462 1 1 0 1761 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5635 M512T2891 511.600006103516 511.600006103516 511.600006103516 2890.66347406525 2890.66347406525 2890.66347406525 1 0 1 3841 Inf 1 0.5
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lecorguille
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5636 M512T3896 511.800018310547 511.800018310547 511.800018310547 3895.70619654764 3895.70619654764 3895.70619654764 1 1 0 4908 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5637 M512T3858 512 512 512 3857.59045806186 3857.59045806186 3857.59045806186 1 0 1 1407 Inf 3.16087744497216 0.195063298463906
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5648 M512T3500 512.299987792969 512.299987792969 512.299987792969 3499.5907337547 3499.5907337547 3499.5907337547 1 0 1 3382 4.47714554000429 2.66028102462668 0.120544196212669
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5652 M512T3280 512.400024414062 512.400024414062 512.400024414062 3279.90396347494 3279.90396347494 3279.90396347494 1 1 0 1247 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5653 M512T2627 512.400024414062 512.400024414062 512.400024414062 2627.41465477536 2627.41465477536 2627.41465477536 1 0 1 53 3.20691262136702 0.656973794567029 0.614950112869492
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5654 M512T4197 512.5 512.5 512.5 4196.59240483364 4196.59240483364 4196.59240483364 1 0 1 6169 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5655 M513T2631 512.700012207031 512.700012207031 512.700012207031 2631.22837961284 2631.22837961284 2631.22837961284 1 1 0 2664 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5656 M513T2798 512.900024414062 512.900024414062 512.900024414062 2797.5855357505 2797.5855357505 2797.5855357505 1 1 0 3947 3.43993386521559 -0.681100978585315 0.605556142891573
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5658 M513T2558 512.900024414062 512.900024414062 512.900024414062 2558.46608488001 2558.46608488001 2558.46608488001 1 0 1 65 2.34633682207408 0.527861729727051 0.671122100038423
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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lecorguille
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5662 M513T3597 513 513 513 3596.57532421235 3596.57532421235 3596.57532421235 1 0 1 1456 Inf 1.8928164649427 0.309423186954904
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lecorguille
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5663 M513T3994 513 513 513 3994.12899266553 3994.12899266553 3994.12899266553 1 1 0 118 10.1725271234265 -2.10987970915896 0.261576362393367
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lecorguille
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5664 M513T3447 513 513 513 3446.75991523983 3446.75991523983 3446.75991523983 1 0 1 2934 Inf 1.72534628574406 0.334403496955874
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lecorguille
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5665 M513T2612 513 513 513 2612.24297459635 2612.24297459635 2612.24297459635 1 1 0 4028 1.16320626520604 -0.193740434695414 0.865496137764904
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lecorguille
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5666 M513T3154 513 513 513 3153.54363378706 3153.54363378706 3153.54363378706 1 1 0 3041 1.83032753673899 -0.398107056874756 0.738563270317939
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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5683 M513T3634 513.400024414062 513.400024414062 513.400024414062 3633.9295464167 3633.9295464167 3633.9295464167 1 0 1 2366 1.78983549962741 0.385239268342234 0.745854425452243
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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5687 M514T4074 513.5 513.5 513.5 4074.17695874045 4074.17695874045 4074.17695874045 1 0 1 3904 Inf 1 0.5
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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5701 M514T2745 514.400024414062 514.400024414062 514.400024414062 2745.40735561032 2745.40735561032 2745.40735561032 1 0 1 4604 Inf 1 0.5
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lecorguille
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lecorguille
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lecorguille
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5704 M514T3250 514.5 514.5 514.5 3249.52994464377 3249.52994464377 3249.52994464377 1 1 0 1927 Inf -1 0.5
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lecorguille
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5705 M514T2764 514.5 514.5 514.5 2764.36299987029 2764.36299987029 2764.36299987029 1 0 1 3808 Inf 1 0.5
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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5709 M514T4135 514.5 514.5 514.5 4134.65820643842 4134.65820643842 4134.65820643842 1 0 1 3991 Inf 1 0.5
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lecorguille
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5710 M514T3851 514.5 514.5 514.5 3851.28370176813 3851.28370176813 3851.28370176813 1 0 1 1409 Inf 1 0.5
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lecorguille
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5711 M515T2739 514.700012207031 514.700012207031 514.700012207031 2738.75585067703 2738.75585067703 2738.75585067703 1 1 0 4437 Inf -1 0.5
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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5719 M515T2882 515 515 515 2882.1284235869 2882.1284235869 2882.1284235869 1 0 1 4741 Inf 1 0.5
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5720 M515T2956 515 515 515 2955.96509420206 2955.96509420206 2955.96509420206 1 0 1 3196 1.00402984241209 0.00284379311648812 0.997989142366771
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lecorguille
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5724 M515T3604 515 515 515 3604.47159932894 3604.47159932894 3604.47159932894 1 1 0 1457 Inf -1 0.5
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5726 M515T2778 515 515 515 2777.62270382815 2777.62270382815 2777.62270382815 1 0 1 4269 Inf 2.54942887611825 0.237970354809879
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5727 M515T3867 515.100036621094 515.100036621094 515.100036621094 3867.25281011878 3867.25281011878 3867.25281011878 1 1 0 1410 1.58701181432078 -0.343052963443008 0.778264576010831
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5729 M515T3401 515.200012207031 515.200012207031 515.200012207031 3400.59245376655 3400.59245376655 3400.59245376655 1 1 0 1331 2.03903215186645 -0.882772978225086 0.52486731744011
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lecorguille
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lecorguille
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5732 M515T3524 515.400024414062 515.400024414062 515.400024414062 3523.66846363941 3523.66846363941 3523.66846363941 1 0 1 357 Inf 1.44831901219557 0.384703965894553
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lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5740 M516T3925 515.900024414062 515.900024414062 515.900024414062 3925.3966577881 3925.3966577881 3925.3966577881 1 0 1 3014 1.20097913183882 0.128601767584902 0.909778825980727
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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5742 M516T2670 515.900024414062 515.900024414062 515.900024414062 2670.15837712702 2670.15837712702 2670.15837712702 1 0 1 4054 Inf 1 0.5
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lecorguille
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5743 M516T2623 515.900024414062 515.900024414062 515.900024414062 2622.66535661694 2622.66535661694 2622.66535661694 1 0 1 2612 Inf 1.32544753522227 0.41147968320993
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5744 M516T2790 515.900024414062 515.900024414062 515.900024414062 2789.52257744508 2789.52257744508 2789.52257744508 1 0 1 [M+Cl]- 480.926 12 Inf 3.05307501309195 0.201506891394382
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lecorguille
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5745 M516T3292 516 516 516 3292.19880652399 3292.19880652399 3292.19880652399 1 0 1 205 1.01323496474335 -0.016886050448363 0.988680886331718
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lecorguille
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5746 M516T3512 516 516 516 3511.8571588571 3511.8571588571 3511.8571588571 1 1 0 4530 37.7538934391091 -1.16276128083684 0.451882628772587
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lecorguille
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5747 M516T3680 516 516 516 3679.76062935955 3679.76062935955 3679.76062935955 1 1 0 3695 Inf -1 0.5
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lecorguille
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5748 M516T3976 516 516 516 3976.03175698205 3976.03175698205 3976.03175698205 1 0 1 1981 4.09630473272359 0.734313191282786 0.585890627230697
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lecorguille
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5749 M516T3995 516 516 516 3995.10126589561 3995.10126589561 3995.10126589561 1 1 0 5443 Inf -1 0.5
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lecorguille
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5750 M516T4063 516.100036621094 516.100036621094 516.100036621094 4062.56884383761 4062.56884383761 4062.56884383761 1 0 1 5800 3.06305972492562 1.18497434395782 0.369492766606984
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lecorguille
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lecorguille
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5752 M516T3101 516.200012207031 516.200012207031 516.200012207031 3101.3386305363 3101.3386305363 3101.3386305363 1 0 1 3149 3.51013409607602 0.984198370496074 0.505021635480055
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lecorguille
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lecorguille
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5754 M516T3136 516.299987792969 516.299987792969 516.299987792969 3136.36151937218 3136.36151937218 3136.36151937218 1 1 0 67 Inf -1 0.5
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5757 M516T2567 516.299987792969 516.299987792969 516.299987792969 2566.85997459635 2566.85997459635 2566.85997459635 1 1 0 5863 Inf -1 0.5
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lecorguille
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5758 M516T3664 516.400024414062 516.400024414062 516.400024414062 3664.0635611465 3664.0635611465 3664.0635611465 1 0 1 454 1.28469661248878 -0.208268128043806 0.855101692741102
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5759 M516T3161 516.400024414062 516.400024414062 516.400024414062 3160.71826144737 3160.71826144737 3160.71826144737 1 0 1 842 Inf 1 0.5
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lecorguille
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5760 M516T3026 516.400024414062 516.400024414062 516.400024414062 3025.67738425226 3025.67738425226 3025.67738425226 1 0 1 39 Inf 1 0.5
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lecorguille
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5761 M516T3786 516.400024414062 516.400024414062 516.400024414062 3786.48422176804 3786.48422176804 3786.48422176804 1 0 1 4458 4.81534253506076 0.775778662016061 0.571443426495247
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5762 M516T3973 516.400024414062 516.400024414062 516.400024414062 3973.47763568642 3973.47763568642 3973.47763568642 1 1 0 2056 1.519897245386 -0.300864001496061 0.799144063122264
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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5763 M516T4176 516.5 516.5 516.5 4176.48836940693 4176.48836940693 4176.48836940693 1 0 1 4413 4.93216715023477 0.781351284559553 0.569552455854212
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lecorguille
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5764 M516T4138 516.5 516.5 516.5 4137.84320879208 4137.84320879208 4137.84320879208 1 1 0 3993 12.1456498852156 -0.914571342053415 0.526741269194555
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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5766 M517T2652 516.799987792969 516.799987792969 516.799987792969 2652.47708210226 2652.47708210226 2652.47708210226 1 1 0 5847 6.0858967691456 -1.05028471667119 0.472859121127737
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5767 M517T2828 516.799987792969 516.799987792969 516.799987792969 2827.71461825419 2827.71461825419 2827.71461825419 1 0 1 4586 Inf 1 0.5
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lecorguille
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5768 M517T2959 516.900024414062 516.900024414062 516.900024414062 2959.30584154654 2954.42138689764 2964.19029619544 2 1 1 3276 1.69619310938767 -0.494164158493545 0.670134184816762
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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5772 M517T3603 516.900024414062 516.900024414062 516.900024414062 3603.14336270008 3603.14336270008 3603.14336270008 1 0 1 1458 2.08501534358325 0.469211936827681 0.700215770911538
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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5783 M517T2678 517.200012207031 517.200012207031 517.200012207031 2677.61167362015 2677.61167362015 2677.61167362015 1 0 1 666 4.71402549918555 0.770716630580748 0.57317089967376
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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5786 M517T2922 517.200012207031 517.200012207031 517.200012207031 2922.13475048773 2922.13475048773 2922.13475048773 1 1 0 [M-H+NaCOOH]- 450.227 60 11.6723329420224 -1.16171508181492 0.451001924343273
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5787 M517T2665 517.299987792969 517.299987792969 517.299987792969 2664.67742188304 2664.67742188304 2664.67742188304 1 1 0 2269 Inf -1 0.5
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5788 M517T2776 517.299987792969 517.299987792969 517.299987792969 2775.7539022167 2775.7539022167 2775.7539022167 1 1 0 151 Inf -1 0.5
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lecorguille
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5790 M517T3080 517.400024414062 517.400024414062 517.400024414062 3080.1356214885 3080.1356214885 3080.1356214885 1 1 0 3530 Inf -1 0.5
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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5795 M518T3789 517.5 517.5 517.5 3788.6647109335 3788.6647109335 3788.6647109335 1 1 0 4459 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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5802 M518T2682 517.799987792969 517.799987792969 517.799987792969 2682.04805809547 2682.04805809547 2682.04805809547 1 1 0 667 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5804 M518T2878 517.900024414062 517.900024414062 517.900024414062 2878.10295048572 2878.10295048572 2878.10295048572 1 0 1 131 Inf 1 0.5
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lecorguille
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5805 M518T3235 517.900024414062 517.900024414062 517.900024414062 3234.68089559805 3234.68089559805 3234.68089559805 1 0 1 2722 Inf 1 0.5
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lecorguille
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lecorguille
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5807 M518T3809 518 518 518 3808.66249884945 3808.66249884945 3808.66249884945 1 0 1 3714 Inf 1 0.5
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lecorguille
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5808 M518T3975 518 518 518 3975.06650309073 3975.06650309073 3975.06650309073 1 1 0 2059 Inf -2.53508704166671 0.23919375755024
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5809 M518T4011 518 518 518 4010.80158041945 4010.80158041945 4010.80158041945 1 1 0 5234 8.57741786470084 -0.877471579515687 0.538340223186697
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lecorguille
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5810 M518T2974 518 518 518 2973.5691622987 2973.5691622987 2973.5691622987 1 1 0 235 2.47336103036712 -1.72021215020281 0.309204611175808
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lecorguille
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lecorguille
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5812 M518T3402 518.200012207031 518.200012207031 518.200012207031 3401.95280216869 3401.7545455561 3402.15105878127 2 1 1 20 1.08408852393833 0.204903987740701 0.868901703298385
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lecorguille
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5813 M518T2919 518.200012207031 518.200012207031 518.200012207031 2919.04838573748 2919.04838573748 2919.04838573748 1 1 0 [M-H-CO]- 547.206 56 4.3188998024808 -0.929167921237626 0.522130095875758
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lecorguille
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5814 M518T3380 518.200012207031 518.200012207031 518.200012207031 3380.22886443151 3380.22886443151 3380.22886443151 1 1 0 [113][M]- 25 1.54720931914964 -0.553316934668494 0.650496763391379
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5815 M518T4475 518.200012207031 518.200012207031 518.200012207031 4474.65822276304 4474.65822276304 4474.65822276304 1 1 0 6202 Inf -1 0.5
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lecorguille
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5816 M518T3507 518.299987792969 518.299987792969 518.299987792969 3507.32334791108 3507.32334791108 3507.32334791108 1 0 1 3383 3.3897786929302 -0.869774049938892 0.530125976171212
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lecorguille
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5817 M518T3127 518.299987792969 518.299987792969 518.299987792969 3127.35763249756 3127.35763249756 3127.35763249756 1 0 1 5592 10.4892331268061 4.77360088354351 0.0618885556052202
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lecorguille
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5818 M518T3663 518.299987792969 518.299987792969 518.299987792969 3662.75963085815 3662.75963085815 3662.75963085815 1 1 0 455 Inf -1 0.5
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lecorguille
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5819 M518T3162 518.299987792969 518.299987792969 518.299987792969 3162.308363342 3162.308363342 3162.308363342 1 0 1 843 Inf 1 0.5
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lecorguille
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5820 M518T3524 518.400024414062 518.400024414062 518.400024414062 3524.46833803987 3524.46833803987 3524.46833803987 1 0 1 424 3.77277800634205 -0.710411867367695 0.594554173805241
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lecorguille
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5821 M518T2884 518.400024414062 518.400024414062 518.400024414062 2883.76802139 2883.76802139 2883.76802139 1 1 0 5500 2.24694302272876 0.507006685533441 0.681203200435108
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lecorguille
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lecorguille
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5823 M518T4072 518.400024414062 518.400024414062 518.400024414062 4071.7068106046 4071.7068106046 4071.7068106046 1 1 0 3854 1.1781144612293 -0.115262021478742 0.919012081051897
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5824 M518T2931 518.400024414062 518.400024414062 518.400024414062 2930.75038801093 2930.75038801093 2930.75038801093 1 1 0 3630 5.16165027407513 -0.791545479597673 0.56612126307191
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lecorguille
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5825 M518T4031 518.400024414062 518.400024414062 518.400024414062 4030.61718280414 4030.61718280414 4030.61718280414 1 1 0 3777 22.8982090308161 -1.4419542857078 0.384540342215509
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lecorguille
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5826 M518T2573 518.400024414062 518.400024414062 518.400024414062 2573.265668269 2573.265668269 2573.265668269 1 0 1 6076 1.78413654618474 0.383389600777328 0.746911100257067
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5827 M518T4009 518.5 518.5 518.5 4009.23164498528 4009.23164498528 4009.23164498528 1 1 0 5235 Inf -1 0.5
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lecorguille
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5828 M519T3808 518.700012207031 518.700012207031 518.700012207031 3808.03828619921 3808.03828619921 3808.03828619921 1 0 1 3715 Inf 1 0.5
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lecorguille
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5829 M519T3269 518.799987792969 518.799987792969 518.799987792969 3268.69554245597 3268.69554245597 3268.69554245597 1 0 1 5476 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5830 M519T3711 518.799987792969 518.799987792969 518.799987792969 3710.63701859526 3710.63701859526 3710.63701859526 1 0 1 1190 Inf 1 0.5
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lecorguille
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5831 M519T2684 518.900024414062 518.900024414062 518.900024414062 2684.41329800875 2684.41329800875 2684.41329800875 1 0 1 6 1.48716640190204 -0.457949759348553 0.713474258662216
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lecorguille
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lecorguille
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5833 M519T3717 518.900024414062 518.900024414062 518.900024414062 3716.91929635642 3716.91929635642 3716.91929635642 1 0 1 1191 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5834 M519T2716 518.900024414062 518.900024414062 518.900024414062 2715.94157338643 2715.94157338643 2715.94157338643 1 0 1 49 3.56844088665133 1.2149769126561 0.378929239789693
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lecorguille
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5835 M519T4141 518.900024414062 518.900024414062 518.900024414062 4140.97627071899 4140.97627071899 4140.97627071899 1 1 0 4241 Inf -2.0089842902741 0.294027417339516
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lecorguille
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5836 M519T2870 518.900024414062 518.900024414062 518.900024414062 2870.23988215442 2870.23988215442 2870.23988215442 1 0 1 4767 12.8211405215074 0.919212088731689 0.525296956654345
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lecorguille
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5837 M519T2968 518.900024414062 518.900024414062 518.900024414062 2967.92374613077 2967.92374613077 2967.92374613077 1 1 0 72 5.90728982955324 -0.819064754358559 0.557024204956365
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lecorguille
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5838 M519T3283 518.900024414062 518.900024414062 518.900024414062 3283.08625547511 3283.08625547511 3283.08625547511 1 1 0 1248 6.48326056100373 -0.965380007432885 0.510524793613243
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lecorguille
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5839 M519T4023 518.900024414062 518.900024414062 518.900024414062 4022.90524572317 4022.90524572317 4022.90524572317 1 0 1 5583 4.49245517205878 0.758832259232414 0.577264581647749
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5840 M519T3938 518.900024414062 518.900024414062 518.900024414062 3938.01213952227 3938.01213952227 3938.01213952227 1 0 1 4166 Inf 1 0.5
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lecorguille
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5841 M519T3290 519 519 519 3289.6928096902 3289.6928096902 3289.6928096902 1 0 1 2116 1.96111733102124 0.47966632263453 0.71003982447006
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lecorguille
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5842 M519T3459 519 519 519 3459.42839377241 3459.42839377241 3459.42839377241 1 0 1 1287 3.35229733374066 1.77084811919122 0.313212939459975
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lecorguille
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5843 M519T3727 519 519 519 3726.59997775795 3726.59997775795 3726.59997775795 1 1 0 84 4.76492788802174 -0.812202822930467 0.558305125292496
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lecorguille
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5844 M519T3938 519 519 519 3938.38339427386 3938.38339427386 3938.38339427386 1 0 1 4179 1.666244424085 0.396866736766999 0.757956517510363
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lecorguille
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5845 M519T3631 519 519 519 3631.25754203364 3631.25754203364 3631.25754203364 1 0 1 2367 Inf 1 0.5
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lecorguille
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5846 M519T4130 519 519 519 4130.33844192957 4130.33844192957 4130.33844192957 1 0 1 [M-H+NaCOOH]- 452.027 23 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5847 M519T2526 519.200012207031 519.200012207031 519.200012207031 2525.60208488001 2525.60208488001 2525.60208488001 1 0 1 5959 3.32428078010377 0.831781320536173 0.557258679933745
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lecorguille
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5848 M519T3380 519.200012207031 519.200012207031 519.200012207031 3380.22886443151 3380.22886443151 3380.22886443151 1 1 0 [113][M+1]- 1585 1.10331962483846 0.0915541900911348 0.9354578766579
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5849 M519T3712 519.299987792969 519.299987792969 519.299987792969 3712.28728409084 3712.28728409084 3712.28728409084 1 1 0 1192 3.82087889317799 -1.12086665430118 0.421932999800621
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lecorguille
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5850 M519T3768 519.299987792969 519.299987792969 519.299987792969 3767.73011661427 3767.73011661427 3767.73011661427 1 1 0 1007 6.03677423645844 -0.823131525553199 0.555698424779754
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lecorguille
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5851 M519T3571 519.299987792969 519.299987792969 519.299987792969 3571.09002855495 3571.09002855495 3571.09002855495 1 1 0 1639 1.17680185833695 -0.114486727804531 0.919550011731017
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lecorguille
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5852 M519T2951 519.299987792969 519.299987792969 519.299987792969 2950.84919741336 2950.84919741336 2950.84919741336 1 1 0 3197 Inf -1.57273370562607 0.360551679674471
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lecorguille
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5853 M519T2991 519.400024414062 519.400024414062 519.400024414062 2990.77752733083 2990.77752733083 2990.77752733083 1 1 0 1844 Inf -1 0.5
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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5920 M523T2877 522.900024414062 522.900024414062 522.900024414062 2877.27897375119 2877.27897375119 2877.27897375119 1 0 1 4743 Inf 1 0.5
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lecorguille
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5921 M523T3068 523 523 523 3068.07361938097 3068.07361938097 3068.07361938097 1 0 1 2438 Inf 1 0.5
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lecorguille
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5922 M523T4037 523 523 523 4036.91062955396 4036.91062955396 4036.91062955396 1 0 1 3778 Inf 1 0.5
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lecorguille
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lecorguille
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lecorguille
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5925 M523T3863 523.100036621094 523.100036621094 523.100036621094 3863.07377179949 3863.07377179949 3863.07377179949 1 0 1 1411 5.12684549463345 0.938580886790891 0.507499330314801
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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5929 M523T3312 523.299987792969 523.299987792969 523.299987792969 3311.73062117219 3311.73062117219 3311.73062117219 1 0 1 503 3.01205069221479 -0.730286175187414 0.583079555851333
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lecorguille
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5930 M523T3274 523.299987792969 523.299987792969 523.299987792969 3273.93376916172 3273.93376916172 3273.93376916172 1 0 1 145 1.87737389113197 0.854583000331943 0.541051500454767
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lecorguille
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5931 M523T3706 523.299987792969 523.299987792969 523.299987792969 3705.93273745051 3705.93273745051 3705.93273745051 1 0 1 1193 1.38840230950628 0.226997676524759 0.843367031716
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lecorguille
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lecorguille
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5933 M523T3542 523.299987792969 523.299987792969 523.299987792969 3542.48800928712 3542.48800928712 3542.48800928712 1 1 0 2322 Inf -1 0.5
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lecorguille
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5934 M523T4142 523.299987792969 523.299987792969 523.299987792969 4142.41184997807 4142.41184997807 4142.41184997807 1 0 1 110 1.07885487263982 0.201471933919573 0.86554319339519
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lecorguille
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5935 M523T4052 523.299987792969 523.299987792969 523.299987792969 4051.5360932026 4051.5360932026 4051.5360932026 1 0 1 [M-H]- 524.306 77 1.65818930706681 0.382654850011621 0.748709039504447
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lecorguille
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lecorguille
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5937 M523T3266 523.400024414062 523.400024414062 523.400024414062 3265.54162507473 3265.54162507473 3265.54162507473 1 1 0 3607 Inf -1 0.5
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5939 M524T2642 523.5 523.5 523.5 2642.46037753233 2642.46037753233 2642.46037753233 1 0 1 5674 Inf 1 0.5
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lecorguille
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5940 M524T2608 523.700012207031 523.700012207031 523.700012207031 2607.54897459635 2607.54897459635 2607.54897459635 1 1 0 4018 Inf -1.59705440395853 0.356142815631507
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5941 M524T3993 524 524 524 3992.54085125997 3992.54085125997 3992.54085125997 1 1 0 [M-H]- 525.005 118 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5943 M524T2985 524 524 524 2985.42539980524 2985.42539980524 2985.42539980524 1 0 1 4634 Inf 1 0.5
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lecorguille
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5944 M524T3078 524.100036621094 524.100036621094 524.100036621094 3077.55344652456 3077.55344652456 3077.55344652456 1 1 0 83 1.52860497948411 1.39249495107837 0.349915443989586
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5945 M524T3464 524.100036621094 524.100036621094 524.100036621094 3463.52836290254 3463.52836290254 3463.52836290254 1 1 0 1288 4.31606559731259 -0.748480373982257 0.580875846217611
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5946 M524T3391 524.100036621094 524.100036621094 524.100036621094 3391.0112085028 3391.0112085028 3391.0112085028 1 1 0 463 1.32322407512861 0.262254412003542 0.819815849335425
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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lecorguille
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5950 M524T3666 524.200012207031 524.200012207031 524.200012207031 3665.99651424678 3665.26863676458 3666.72439172897 2 1 1 [117][M]- [M-H]- 525.213 2 1.31892986375035 -0.818898346669291 0.55256698226563
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5958 M524T2522 524.299987792969 524.299987792969 524.299987792969 2521.622668269 2521.622668269 2521.622668269 1 0 1 5055 Inf 1 0.5
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lecorguille
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5959 M524T3060 524.299987792969 524.299987792969 524.299987792969 3059.67590615795 3059.67590615795 3059.67590615795 1 1 0 5910 2.84660879160651 -0.612037870327051 0.633327253557687
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lecorguille
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5960 M524T2927 524.299987792969 524.299987792969 524.299987792969 2926.78638974879 2926.78638974879 2926.78638974879 1 1 0 [M-2H+Na]- 503.312 60 1.66323207045351 -0.397727177359979 0.751901227953369
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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5962 M524T2626 524.400024414062 524.400024414062 524.400024414062 2625.83156900656 2625.83156900656 2625.83156900656 1 0 1 2623 Inf 1 0.5
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lecorguille
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5963 M524T2763 524.400024414062 524.400024414062 524.400024414062 2763.17025562925 2763.17025562925 2763.17025562925 1 1 0 3810 2.43046422386213 -0.544286242731651 0.663386452726681
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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5965 M525T2662 524.900024414062 524.900024414062 524.900024414062 2662.07186957376 2662.07186957376 2662.07186957376 1 1 0 2271 1.89260669465664 -0.731536909595784 0.589787564914009
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lecorguille
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lecorguille
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5967 M525T2778 524.900024414062 524.900024414062 524.900024414062 2777.62270382815 2777.62270382815 2777.62270382815 1 0 1 4269 1.74365227313804 0.369966033561014 0.754643811943925
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lecorguille
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5969 M525T2637 525 525 525 2636.9130391935 2636.9130391935 2636.9130391935 1 0 1 2634 2.63952367695686 0.710999286465772 0.574426452518504
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5970 M525T4176 525 525 525 4176.09171998227 4176.09171998227 4176.09171998227 1 0 1 4414 1.70190955064495 0.388892965361045 0.753358561069256
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5971 M525T3475 525 525 525 3474.60922997909 3474.60922997909 3474.60922997909 1 1 0 1807 1.63039265602227 -0.329593468597413 0.778561597818508
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5973 M525T4015 525 525 525 4015.11576581835 4015.11576581835 4015.11576581835 1 0 1 6092 1.17269435835309 0.144775363621463 0.907284170456054
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5974 M525T3461 525.100036621094 525.100036621094 525.100036621094 3460.67099542738 3460.67099542738 3460.67099542738 1 1 0 1290 1.25104645209139 0.20236520559205 0.859818690652786
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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6087 M530T4022 529.5 529.5 529.5 4021.78945626923 4021.78945626923 4021.78945626923 1 1 0 5584 Inf -1 0.5
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lecorguille
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6088 M530T4046 529.5 529.5 529.5 4046.4478393435 4046.4478393435 4046.4478393435 1 1 0 4124 Inf -1 0.5
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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6146 M532T3790 532.400024414062 532.400024414062 532.400024414062 3789.65430237007 3789.65430237007 3789.65430237007 1 0 1 4461 Inf 1 0.5
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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6149 M533T3301 532.900024414062 532.900024414062 532.900024414062 3300.71045984215 3300.71045984215 3300.71045984215 1 0 1 5391 Inf 1 0.5
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6150 M533T2544 532.900024414062 532.900024414062 532.900024414062 2544.38208488001 2544.38208488001 2544.38208488001 1 0 1 5167 Inf 1 0.5
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6151 M533T2899 532.900024414062 532.900024414062 532.900024414062 2898.92238702059 2898.92238702059 2898.92238702059 1 1 0 4781 Inf -1 0.5
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lecorguille
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6152 M533T2770 532.900024414062 532.900024414062 532.900024414062 2770.25377108692 2770.25377108692 2770.25377108692 1 0 1 5125 Inf 1 0.5
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lecorguille
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6153 M533T2844 532.900024414062 532.900024414062 532.900024414062 2843.52301358735 2843.52301358735 2843.52301358735 1 0 1 5529 1.13536483146669 0.089470094123969 0.93697621989621
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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6157 M533T3124 533 533 533 3123.51949652457 3123.51949652457 3123.51949652457 1 0 1 5081 Inf 1 0.5
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lecorguille
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6160 M533T3040 533 533 533 3039.70291287453 3039.70291287453 3039.70291287453 1 0 1 3229 4.4419863330082 0.75595592419171 0.578263646605974
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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6175 M533T2684 533.299987792969 533.299987792969 533.299987792969 2683.62713632746 2683.62713632746 2683.62713632746 1 1 0 668 3.41462542049559 -0.707141599881141 0.608158394946975
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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6179 M533T2738 533.400024414062 533.400024414062 533.400024414062 2737.68724200948 2737.68724200948 2737.68724200948 1 0 1 4438 Inf 1 0.5
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lecorguille
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6180 M533T3675 533.400024414062 533.400024414062 533.400024414062 3675.11742348635 3675.11742348635 3675.11742348635 1 0 1 89 Inf 2.6377352423768 0.230693050031162
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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6187 M534T2672 533.900024414062 533.900024414062 533.900024414062 2671.74124426513 2671.74124426513 2671.74124426513 1 0 1 4055 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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6194 M534T3675 534.100036621094 534.100036621094 534.100036621094 3675.11742348635 3675.11742348635 3675.11742348635 1 0 1 89 2.37844029175365 0.534255978749578 0.668089272826512
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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6201 M534T3864 534.299987792969 534.299987792969 534.299987792969 3864.19010467896 3860.59003269214 3867.79017666577 2 1 1 [2M-H+Cl]2- 517.327 21 1.5725135511838 -0.400940518269769 0.731745247781109
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lecorguille
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6202 M534T2893 534.299987792969 534.299987792969 534.299987792969 2893.20674873382 2893.20674873382 2893.20674873382 1 1 0 3842 1.55933022823478 -0.301943446715495 0.795488037558641
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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6210 M534T3929 534.400024414062 534.400024414062 534.400024414062 3928.55077768856 3928.55077768856 3928.55077768856 1 0 1 3016 Inf 1 0.5
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lecorguille
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6211 M534T3903 534.400024414062 534.400024414062 534.400024414062 3903.31811241095 3903.31811241095 3903.31811241095 1 0 1 4852 Inf 2.17383463339096 0.274480165066037
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lecorguille
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lecorguille
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lecorguille
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6214 M534T3279 534.400024414062 534.400024414062 534.400024414062 3278.66099664615 3278.66099664615 3278.66099664615 1 0 1 18 Inf 1 0.5
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lecorguille
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6215 M534T3815 534.400024414062 534.400024414062 534.400024414062 3814.99155790501 3814.99155790501 3814.99155790501 1 0 1 2398 Inf 1 0.5
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6216 M534T2534 534.400024414062 534.400024414062 534.400024414062 2534.142668269 2534.142668269 2534.142668269 1 0 1 5893 6.96354702510612 0.84769884207724 0.547776568558436
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lecorguille
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6217 M534T3809 534.5 534.5 534.5 3808.66249884945 3808.66249884945 3808.66249884945 1 0 1 3717 Inf 1 0.5
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6218 M535T4171 534.600036621094 534.600036621094 534.600036621094 4170.85203292154 4170.85203292154 4170.85203292154 1 1 0 5931 Inf -1 0.5
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6219 M535T2620 534.600036621094 534.600036621094 534.600036621094 2619.50008488001 2619.50008488001 2619.50008488001 1 0 1 2668 Inf 1.83559633215756 0.31756396561763
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6220 M535T2700 534.700012207031 534.700012207031 534.700012207031 2700.3977849365 2700.3977849365 2700.3977849365 1 0 1 4874 1.54226332227444 0.295014508199624 0.799795726733755
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6221 M535T2584 534.700012207031 534.700012207031 534.700012207031 2584.220668269 2584.220668269 2584.220668269 1 0 1 5747 Inf 1 0.5
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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lecorguille
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6271 M536T4464 536.5 536.5 536.5 4463.81374443202 4463.81374443202 4463.81374443202 1 0 1 6244 Inf 1 0.5
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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6280 M537T3822 537.100036621094 537.100036621094 537.100036621094 3822.14551586643 3822.14551586643 3822.14551586643 1 0 1 1893 Inf 1 0.5
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lecorguille
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6281 M537T3967 537.100036621094 537.100036621094 537.100036621094 3967.12299579339 3967.12299579339 3967.12299579339 1 1 0 2062 4.94072428514802 -0.781748854120957 0.569417969398826
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lecorguille
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6282 M537T3797 537.100036621094 537.100036621094 537.100036621094 3796.52016087278 3796.52016087278 3796.52016087278 1 1 0 4621 Inf -1 0.5
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lecorguille
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6283 M537T3711 537.200012207031 537.200012207031 537.200012207031 3710.90650411928 3704.36614312564 3715.97372975256 4 2 2 [128][M+1]- 17 1.03358022711152 0.0688559644284577 0.956181926471241
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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6295 M537T2652 537.400024414062 537.400024414062 537.400024414062 2652.47708210226 2652.47708210226 2652.47708210226 1 1 0 5848 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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6296 M537T4132 537.400024414062 537.400024414062 537.400024414062 4131.57917077552 4131.57917077552 4131.57917077552 1 1 0 1509 57.530762768807 -1.22884419472773 0.434717793643242
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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6300 M537T3459 537.400024414062 537.400024414062 537.400024414062 3459.11913513146 3459.11913513146 3459.11913513146 1 1 0 19 Inf -1 0.5
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lecorguille
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6301 M538T2909 537.5 537.5 537.5 2908.98972164108 2908.98972164108 2908.98972164108 1 1 0 2778 Inf -1 0.5
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lecorguille
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6302 M538T2853 537.700012207031 537.700012207031 537.700012207031 2852.77211751114 2852.77211751114 2852.77211751114 1 1 0 4267 Inf -1 0.5
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lecorguille
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6303 M538T2691 537.799987792969 537.799987792969 537.799987792969 2691.44503823285 2691.44503823285 2691.44503823285 1 1 0 670 2.34821626373874 -0.528240502121238 0.670941689009048
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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lecorguille
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6307 M538T3506 538.100036621094 538.100036621094 538.100036621094 3505.62363008716 3505.62363008716 3505.62363008716 1 1 0 3385 2.84005948404893 -0.918666790389485 0.526898349584568
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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6315 M538T4135 538.299987792969 538.299987792969 538.299987792969 4134.69052869721 4134.66950325724 4134.71155413718 2 2 0 [2M-H+Cl]2- 521.31 99 2.34630445846769 -4.01000660486542 0.148982791903032
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lecorguille
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6316 M538T2885 538.299987792969 538.299987792969 538.299987792969 2885.36146766203 2885.36146766203 2885.36146766203 1 0 1 5663 Inf 1 0.5
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lecorguille
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6317 M538T4096 538.299987792969 538.299987792969 538.299987792969 4095.52908489535 4095.52908489535 4095.52908489535 1 1 0 150 1.18820555224805 -0.485466872433627 0.711035282267319
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lecorguille
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6318 M538T3462 538.299987792969 538.299987792969 538.299987792969 3462.21813542294 3462.21813542294 3462.21813542294 1 1 0 19 Inf -1 0.5
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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6327 M538T3459 538.400024414062 538.400024414062 538.400024414062 3459.11913513146 3459.11913513146 3459.11913513146 1 1 0 1292 Inf -1 0.5
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lecorguille
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6328 M538T2633 538.5 538.5 538.5 2632.9421830118 2632.9421830118 2632.9421830118 1 0 1 2670 4.39375510432739 0.753144147744172 0.579243497959136
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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6330 M538T2613 538.5 538.5 538.5 2612.53628676082 2612.53628676082 2612.53628676082 1 1 0 100 Inf -1 0.5
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lecorguille
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6331 M539T2738 538.700012207031 538.700012207031 538.700012207031 2737.68724200948 2737.68724200948 2737.68724200948 1 0 1 4439 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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6332 M539T2541 538.799987792969 538.799987792969 538.799987792969 2541.25208488001 2541.25208488001 2541.25208488001 1 0 1 5553 Inf 1 0.5
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lecorguille
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6333 M539T2632 538.799987792969 538.799987792969 538.799987792969 2632.16386004811 2632.16386004811 2632.16386004811 1 0 1 2627 Inf 1 0.5
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lecorguille
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lecorguille
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lecorguille
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6339 M539T3633 539 539 539 3632.64692080216 3632.64692080216 3632.64692080216 1 1 0 45 4.26319762695182 -0.745207716824952 0.582026679162879
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6340 M539T3377 539 539 539 3377.39784471179 3377.39784471179 3377.39784471179 1 1 0 1588 Inf -1 0.5
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6345 M539T4075 539.100036621094 539.100036621094 539.100036621094 4075.14194222414 4075.14194222414 4075.14194222414 1 1 0 3907 4.65367861033729 -0.767594368393655 0.574241155651461
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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6408 M541T2916 541.200012207031 541.200012207031 541.200012207031 2915.96882550519 2915.96882550519 2915.96882550519 1 1 0 56 Inf -2.67696934118124 0.227594602781171
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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6417 M542T3369 541.799987792969 541.799987792969 541.799987792969 3369.42791356154 3369.42791356154 3369.42791356154 1 0 1 5764 Inf 1 0.5
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lecorguille
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6418 M542T3229 541.900024414062 541.900024414062 541.900024414062 3228.92889420406 3228.92889420406 3228.92889420406 1 0 1 2725 Inf 1 0.5
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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6428 M542T3821 542.100036621094 542.100036621094 542.100036621094 3820.64233541388 3820.64233541388 3820.64233541388 1 1 0 1865 9.69785469705602 -0.892153894360261 0.53373486147261
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lecorguille
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6429 M542T3587 542.100036621094 542.100036621094 542.100036621094 3587.0408957916 3587.0408957916 3587.0408957916 1 0 1 1705 1.44904321092173 0.336167653859416 0.778896636157316
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lecorguille
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6430 M542T3777 542.100036621094 542.100036621094 542.100036621094 3777.31229116986 3777.31229116986 3777.31229116986 1 1 0 3681 7.1727230690957 -0.852339290442261 0.546295310171543
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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6435 M542T3650 542.400024414062 542.400024414062 542.400024414062 3649.75436085664 3649.75436085664 3649.75436085664 1 1 0 1519 6.13598188085191 -0.832761996185081 0.555654311852323
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lecorguille
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6436 M542T3017 542.400024414062 542.400024414062 542.400024414062 3017.48765252941 3017.48765252941 3017.48765252941 1 1 0 2156 Inf -1 0.5
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lecorguille
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6437 M542T4146 542.5 542.5 542.5 4145.51429793861 4145.51429793861 4145.51429793861 1 0 1 219 2.14289542518368 0.704197336896326 0.557908665075159
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lecorguille
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6438 M543T3402 542.600036621094 542.600036621094 542.600036621094 3401.7545455561 3401.7545455561 3401.7545455561 1 0 1 1332 Inf 1 0.5
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lecorguille
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6439 M543T2635 542.799987792969 542.799987792969 542.799987792969 2634.52854278345 2634.52854278345 2634.52854278345 1 0 1 2671 Inf 1 0.5
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lecorguille
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6440 M543T2710 542.799987792969 542.799987792969 542.799987792969 2710.2502608607 2710.2502608607 2710.2502608607 1 0 1 5879 Inf 1 0.5
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lecorguille
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6441 M543T2905 542.900024414062 542.900024414062 542.900024414062 2904.72065631416 2904.72065631416 2904.72065631416 1 0 1 3924 Inf 1.55767136301917 0.363331237307496
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lecorguille
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6442 M543T3661 542.900024414062 542.900024414062 542.900024414062 3661.21003277018 3661.21003277018 3661.21003277018 1 1 0 456 Inf -1 0.5
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lecorguille
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6443 M543T2850 542.900024414062 542.900024414062 542.900024414062 2850.24757333891 2850.24757333891 2850.24757333891 1 1 0 5772 3.75615991580193 -0.709071985075861 0.595047775611679
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lecorguille
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6444 M543T3791 542.900024414062 542.900024414062 542.900024414062 3790.84576766149 3790.84576766149 3790.84576766149 1 0 1 4462 Inf 1 0.5
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lecorguille
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6445 M543T3858 543 543 543 3857.59045806186 3857.59045806186 3857.59045806186 1 0 1 1417 Inf 1 0.5
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lecorguille
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6446 M543T3781 543 543 543 3780.8131657858 3780.8131657858 3780.8131657858 1 1 0 3682 Inf -1 0.5
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lecorguille
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6447 M543T2577 543 543 543 2577.24608488001 2577.24608488001 2577.24608488001 1 0 1 4078 3.18167631692452 1.03240793945947 0.476299700931823
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lecorguille
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6448 M543T3934 543.100036621094 543.100036621094 543.100036621094 3933.9854820432 3930.87032184293 3937.10064224346 2 1 0 2957 2.41950636434116 -0.615591360432559 0.632442186295523
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lecorguille
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6449 M543T3847 543.100036621094 543.100036621094 543.100036621094 3846.55379737878 3846.55379737878 3846.55379737878 1 0 1 [130][M+1]- 1343 1.65007085031939 0.378977967134066 0.7559730851843
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lecorguille
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6450 M543T4029 543.200012207031 543.200012207031 543.200012207031 4029.13245804437 4029.13245804437 4029.13245804437 1 0 1 3784 1.94425682748692 1.00788236378875 0.419794886141842
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lecorguille
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lecorguille
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lecorguille
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6453 M543T3637 543.299987792969 543.299987792969 543.299987792969 3637.35902306758 3637.35902306758 3637.35902306758 1 0 1 2856 7.87216651925062 0.891056512052527 0.536600004365034
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lecorguille
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6454 M543T3903 543.299987792969 543.299987792969 543.299987792969 3902.86916864942 3902.86916864942 3902.86916864942 1 1 0 4798 5.64546186854877 -0.997172666407253 0.496646583593864
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lecorguille
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lecorguille
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6456 M543T3709 543.400024414062 543.400024414062 543.400024414062 3709.45764983761 3709.45764983761 3709.45764983761 1 1 0 1199 Inf -1.50425072011397 0.37350307059779
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lecorguille
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6457 M543T2810 543.400024414062 543.400024414062 543.400024414062 2810.48157468179 2810.48157468179 2810.48157468179 1 0 1 3325 Inf 1 0.5
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lecorguille
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6458 M544T2945 543.5 543.5 543.5 2944.63769621478 2944.63769621478 2944.63769621478 1 1 0 2818 Inf -1.30988053464447 0.415101579777943
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lecorguille
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6459 M544T2977 543.5 543.5 543.5 2976.69697715884 2976.69697715884 2976.69697715884 1 1 0 5285 Inf -1 0.5
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lecorguille
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6460 M544T3997 543.5 543.5 543.5 3997.30497933253 3997.30497933253 3997.30497933253 1 1 0 5445 Inf -1 0.5
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lecorguille
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6461 M544T4103 543.600036621094 543.600036621094 543.600036621094 4103.36860044401 4103.36860044401 4103.36860044401 1 1 0 6176 Inf -1 0.5
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lecorguille
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6462 M544T2860 543.700012207031 543.700012207031 543.700012207031 2859.59099996184 2859.59099996184 2859.59099996184 1 1 0 4251 Inf -1 0.5
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lecorguille
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6463 M544T2805 543.700012207031 543.700012207031 543.700012207031 2804.56537064767 2804.56537064767 2804.56537064767 1 0 1 5190 Inf 1 0.5
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lecorguille
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6464 M544T2633 543.799987792969 543.799987792969 543.799987792969 2632.9421830118 2632.9421830118 2632.9421830118 1 0 1 2672 7.07993074782683 0.8503156860759 0.546940723177298
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lecorguille
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6465 M544T3710 543.900024414062 543.900024414062 543.900024414062 3709.71158625368 3709.71158625368 3709.71158625368 1 0 1 [M-H]- 544.906 17 1.04997800423259 0.034467967747999 0.975641284542275
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lecorguille
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6466 M544T2847 543.900024414062 543.900024414062 543.900024414062 2846.64296187928 2846.64296187928 2846.64296187928 1 0 1 5530 Inf 2.12422357055322 0.280102128142985
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lecorguille
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lecorguille
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6468 M544T2535 544 544 544 2534.99208488001 2534.99208488001 2534.99208488001 1 0 1 210 6.67714608357361 1.20975037170274 0.426127460716823
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lecorguille
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6469 M544T3832 544 544 544 3831.89579609347 3831.89579609347 3831.89579609347 1 1 0 3340 4.60959673354047 -0.944476055303781 0.501470794726516
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lecorguille
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6470 M544T3227 544.100036621094 544.100036621094 544.100036621094 3227.11972276977 3222.15019772111 3232.08924781844 2 0 2 5507 2.20276035627755 1.20270641193317 0.441551580490779
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
parents:
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lecorguille
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lecorguille
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lecorguille
parents:
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lecorguille
parents:
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
parents:
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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6587 M548T2972 548.5 548.5 548.5 2972.00551375253 2972.00551375253 2972.00551375253 1 1 0 3278 Inf -1 0.5
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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6655 M550T3962 550.5 550.5 550.5 3962.35621613294 3962.35621613294 3962.35621613294 1 1 0 6135 Inf -1 0.5
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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6658 M551T2700 550.700012207031 550.700012207031 550.700012207031 2700.3977849365 2700.3977849365 2700.3977849365 1 0 1 4877 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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6659 M551T4314 550.700012207031 550.700012207031 550.700012207031 4314.24615089905 4314.24615089905 4314.24615089905 1 0 1 6128 Inf 1 0.5
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lecorguille
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6660 M551T2592 550.700012207031 550.700012207031 550.700012207031 2592.045668269 2592.045668269 2592.045668269 1 0 1 2908 Inf 1 0.5
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lecorguille
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6661 M551T4292 550.799987792969 550.799987792969 550.799987792969 4291.66874443202 4291.66874443202 4291.66874443202 1 0 1 344 Inf 1 0.5
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lecorguille
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6662 M551T2942 550.900024414062 550.900024414062 550.900024414062 2941.53817449469 2941.53817449469 2941.53817449469 1 1 0 2821 Inf -1 0.5
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lecorguille
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6663 M551T3197 550.900024414062 550.900024414062 550.900024414062 3197.13453393345 3197.13453393345 3197.13453393345 1 0 1 1763 Inf 1 0.5
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lecorguille
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6664 M551T2699 550.900024414062 550.900024414062 550.900024414062 2698.54017611806 2698.54017611806 2698.54017611806 1 1 0 5074 Inf -1 0.5
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lecorguille
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6665 M551T2594 550.900024414062 550.900024414062 550.900024414062 2593.75628676082 2593.75628676082 2593.75628676082 1 1 0 2909 Inf -2.50768568563345 0.241564790124972
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lecorguille
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6666 M551T3355 550.900024414062 550.900024414062 550.900024414062 3354.62837029494 3354.62837029494 3354.62837029494 1 0 1 736 Inf 1 0.5
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lecorguille
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6667 M551T3507 551.100036621094 551.100036621094 551.100036621094 3507.17741350176 3507.17741350176 3507.17741350176 1 1 0 76 5.72744712179595 -1.32940131534565 0.385785399423795
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lecorguille
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6668 M551T3581 551.200012207031 551.200012207031 551.200012207031 3580.74347186621 3580.63962475463 3580.84731897778 2 1 1 1644 1.00468741660419 -0.0522042649266529 0.965350357199645
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lecorguille
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6669 M551T4472 551.200012207031 551.200012207031 551.200012207031 4472.30715089905 4472.30715089905 4472.30715089905 1 0 1 6102 2.62577655078224 0.578619373795658 0.647787641895986
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lecorguille
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6670 M551T3664 551.200012207031 551.200012207031 551.200012207031 3664.0635611465 3664.0635611465 3664.0635611465 1 0 1 [136][M+1]- 2 1.2439849834266 -0.505177188086903 0.691253738392901
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lecorguille
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6671 M551T3767 551.200012207031 551.200012207031 551.200012207031 3767.4640225918 3767.4640225918 3767.4640225918 1 0 1 958 1.54156784541482 0.657908605640293 0.598977955606484
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lecorguille
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6672 M551T3010 551.200012207031 551.200012207031 551.200012207031 3009.90522827653 3009.90522827653 3009.90522827653 1 0 1 37 3.33088423561773 0.778490165259357 0.573285751625013
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lecorguille
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6673 M551T3647 551.200012207031 551.200012207031 551.200012207031 3646.64773058066 3646.64773058066 3646.64773058066 1 1 0 [135][M+1]- 24 1.34911298805389 -1.16779564767247 0.447581001862455
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lecorguille
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6674 M551T4004 551.200012207031 551.200012207031 551.200012207031 4004.24205172645 4004.24205172645 4004.24205172645 1 0 1 5821 3.88313593908559 0.719016819550115 0.591404616661741
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lecorguille
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6675 M551T2914 551.200012207031 551.200012207031 551.200012207031 2914.42997824767 2914.42997824767 2914.42997824767 1 1 0 56 6.95490812479858 -0.940584602655063 0.513284471227766
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lecorguille
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6676 M551T2844 551.200012207031 551.200012207031 551.200012207031 2843.52301358735 2843.52301358735 2843.52301358735 1 0 1 5524 7.62386098314982 3.67352319281695 0.0819356932815363
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lecorguille
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6677 M551T3859 551.299987792969 551.299987792969 551.299987792969 3859.36757255571 3859.36757255571 3859.36757255571 1 1 0 [3M-2H]2- 368.206 [M-H]- 552.308 21 1.17197008266038 -0.126126037400879 0.911708653676608
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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6678 M551T3847 551.299987792969 551.299987792969 551.299987792969 3846.55379737878 3846.55379737878 3846.55379737878 1 0 1 [3M-2H]2- 368.206 [M-H]- 552.308 21 1.42831831466829 0.289021715424652 0.801175214854938
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lecorguille
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6679 M551T4447 551.299987792969 551.299987792969 551.299987792969 4446.59974443202 4446.59974443202 4446.59974443202 1 0 1 324 Inf 1 0.5
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lecorguille
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6680 M551T3627 551.299987792969 551.299987792969 551.299987792969 3626.73281907078 3626.73281907078 3626.73281907078 1 0 1 [137][M+1]- 1623 3.651383806483 -2.37837834747445 0.185429877281658
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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6681 M551T2823 551.299987792969 551.299987792969 551.299987792969 2823.02392446804 2823.02392446804 2823.02392446804 1 0 1 3309 Inf 5.78494161248735 0.108970856565666
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lecorguille
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6682 M551T3020 551.299987792969 551.299987792969 551.299987792969 3019.55649792067 3019.55649792067 3019.55649792067 1 0 1 2157 Inf 1 0.5
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lecorguille
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6683 M551T4095 551.400024414062 551.400024414062 551.400024414062 4094.7449198242 4090.82480317652 4098.66503647187 2 1 0 5116 2.17149449547878 -1.08440920064857 0.43686484109059
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lecorguille
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6684 M551T4119 551.400024414062 551.400024414062 551.400024414062 4119.04385073737 4119.04385073737 4119.04385073737 1 1 0 4543 1.69604633278387 -0.439447961127543 0.7314584533539
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lecorguille
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6685 M551T4132 551.400024414062 551.400024414062 551.400024414062 4131.55437805172 4131.55437805172 4131.55437805172 1 0 1 1511 7.39890168176266 0.857052373381061 0.544795189966077
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lecorguille
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6686 M551T3513 551.400024414062 551.400024414062 551.400024414062 3513.42292224559 3513.42292224559 3513.42292224559 1 1 0 4533 10.9769233408301 -0.905151514455808 0.529675844764283
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lecorguille
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6687 M551T3965 551.400024414062 551.400024414062 551.400024414062 3965.26695536726 3965.26695536726 3965.26695536726 1 1 0 [M+Cl+CF3COOH]- 382.433 [M-H+CF3COOH]- 418.409 36 8.75763773707792 -0.905297053941539 0.529592352305592
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lecorguille
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6688 M551T3166 551.400024414062 551.400024414062 551.400024414062 3165.92062463944 3165.92062463944 3165.92062463944 1 0 1 848 Inf 1.22970579552228 0.434645558627154
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lecorguille
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6689 M552T2906 551.5 551.5 551.5 2906.29720589096 2906.29720589096 2906.29720589096 1 0 1 3925 Inf 1.17509956809874 0.448861201029215
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lecorguille
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6690 M552T4251 551.5 551.5 551.5 4250.86922276304 4250.86922276304 4250.86922276304 1 1 0 327 4.86445406574718 -1.59655996134591 0.300902276718008
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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6691 M552T2707 551.600036621094 551.600036621094 551.600036621094 2706.96523737293 2706.96523737293 2706.96523737293 1 0 1 4878 Inf 1 0.5
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lecorguille
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6692 M552T4387 551.700012207031 551.700012207031 551.700012207031 4386.70240158956 4386.70240158956 4386.70240158956 1 1 0 340 Inf -1 0.5
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lecorguille
parents:
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6693 M552T3721 551.900024414062 551.900024414062 551.900024414062 3721.28756812118 3720.34560644218 3722.22952980018 2 1 1 78 5.53271162900921 -0.806194207884149 0.561250415071347
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lecorguille
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lecorguille
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lecorguille
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6696 M552T2611 551.900024414062 551.900024414062 551.900024414062 2610.824668269 2610.824668269 2610.824668269 1 0 1 4019 1.74525833896539 4.23307362271611 0.123137172299092
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lecorguille
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6697 M552T2892 552 552 552 2891.82468804952 2891.82468804952 2891.82468804952 1 0 1 3844 Inf 13.2686243326782 0.0478888025276003
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lecorguille
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6698 M552T3200 552 552 552 3200.42770832779 3200.42770832779 3200.42770832779 1 0 1 30 1.04592562717952 -0.0317373646662896 0.977569082335681
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lecorguille
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6699 M552T4162 552.100036621094 552.100036621094 552.100036621094 4161.66086245462 4158.27843441166 4165.04329049758 2 1 1 250 1.0015727096755 0.00151871486663764 0.999009870761937
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lecorguille
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6700 M552T2633 552.100036621094 552.100036621094 552.100036621094 2632.82382808517 2632.82382808517 2632.82382808517 1 1 0 2631 1.11010618422928 0.506409535652488 0.685912018967999
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lecorguille
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lecorguille
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lecorguille
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6703 M552T3888 552.200012207031 552.200012207031 552.200012207031 3888.20586232792 3888.20586232792 3888.20586232792 1 0 1 41 3.85333883728418 0.759727566916679 0.575728214446826
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lecorguille
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6704 M552T3348 552.200012207031 552.200012207031 552.200012207031 3347.8458781399 3347.8458781399 3347.8458781399 1 0 1 700 1.72037367498487 2.41043871708852 0.181989827780995
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lecorguille
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6705 M552T3825 552.299987792969 552.299987792969 552.299987792969 3825.37636821272 3825.28704007745 3825.465696348 2 1 1 [138][M]- 1863 4.60288186930631 -0.877513712207557 0.540816717443912
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lecorguille
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6706 M552T3855 552.299987792969 552.299987792969 552.299987792969 3855.32546820916 3849.7070509607 3860.94388545761 2 1 1 [139][M]- [M+Cl]- 517.327 21 1.31157724061439 -3.5942045560528 0.168050054218307
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lecorguille
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6707 M552T3876 552.299987792969 552.299987792969 552.299987792969 3875.64648590193 3875.64648590193 3875.64648590193 1 0 1 [M+Cl]- 517.328 55 1.27589039919856 0.351192995974107 0.77571968583016
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lecorguille
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6708 M552T3631 552.299987792969 552.299987792969 552.299987792969 3630.7372705795 3630.7372705795 3630.7372705795 1 0 1 2359 1.38423386411662 0.294303288847376 0.796995598684775
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lecorguille
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6709 M552T4226 552.400024414062 552.400024414062 552.400024414062 4226.21625120297 4225.82335150688 4226.60915089905 2 1 1 5430 2.337186801171 -0.614345279767369 0.619010840906378
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lecorguille
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6710 M552T3823 552.400024414062 552.400024414062 552.400024414062 3823.22242960042 3823.22242960042 3823.22242960042 1 1 0 1852 Inf -1 0.5
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lecorguille
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6711 M552T3836 552.400024414062 552.400024414062 552.400024414062 3835.51794589405 3835.51794589405 3835.51794589405 1 0 1 3360 Inf 1.25734456939388 0.427735281229187
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lecorguille
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6712 M552T3309 552.400024414062 552.400024414062 552.400024414062 3308.58072998214 3308.58072998214 3308.58072998214 1 0 1 557 Inf 1.80560117840665 0.321989934444034
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lecorguille
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6713 M552T2689 552.400024414062 552.400024414062 552.400024414062 2689.1582708786 2689.1582708786 2689.1582708786 1 1 0 673 14.1158537219503 -0.926834854989896 0.522925704590133
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lecorguille
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6714 M552T4469 552.400024414062 552.400024414062 552.400024414062 4469.17715089905 4469.17715089905 4469.17715089905 1 0 1 6194 Inf 1.65849995201196 0.345422943755514
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6715 M552T3152 552.400024414062 552.400024414062 552.400024414062 3151.86591620274 3151.86591620274 3151.86591620274 1 0 1 3047 Inf 1 0.5
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lecorguille
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6718 M552T4321 552.5 552.5 552.5 4320.50615089905 4320.50615089905 4320.50615089905 1 0 1 336 Inf 1 0.5
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lecorguille
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6719 M552T2806 552.5 552.5 552.5 2805.77058037431 2805.77058037431 2805.77058037431 1 0 1 154 Inf 1 0.5
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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6742 M553T3936 553.299987792969 553.299987792969 553.299987792969 3936.43507866832 3936.43507866832 3936.43507866832 1 0 1 4128 3.45066770187108 1.42440900074036 0.386745067287308
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lecorguille
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6743 M553T3475 553.299987792969 553.299987792969 553.299987792969 3474.57089610668 3474.57089610668 3474.57089610668 1 0 1 1810 Inf 1 0.5
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lecorguille
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6744 M553T3171 553.299987792969 553.299987792969 553.299987792969 3170.77113798805 3170.77113798805 3170.77113798805 1 1 0 793 1.09776614361183 -0.0885664919383143 0.940492302666243
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lecorguille
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lecorguille
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6746 M553T2885 553.400024414062 553.400024414062 553.400024414062 2884.67981628485 2884.67981628485 2884.67981628485 1 1 0 5657 6.65097457429819 -0.840202238689878 0.550179052440301
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lecorguille
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6747 M553T4097 553.400024414062 553.400024414062 553.400024414062 4097.43616617479 4097.43616617479 4097.43616617479 1 0 1 5109 Inf 1.41909786765101 0.390792452168771
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lecorguille
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6748 M553T3842 553.400024414062 553.400024414062 553.400024414062 3841.8240416177 3841.8240416177 3841.8240416177 1 0 1 1419 33.7824541957437 0.969973968427331 0.509476642861064
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lecorguille
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lecorguille
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6750 M553T4139 553.400024414062 553.400024414062 553.400024414062 4139.30926202987 4139.30926202987 4139.30926202987 1 0 1 3997 12.9885871084442 0.920285835668169 0.524962873425826
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lecorguille
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lecorguille
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lecorguille
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6753 M553T2992 553.400024414062 553.400024414062 553.400024414062 2992.48483717013 2992.48483717013 2992.48483717013 1 0 1 1827 1.09241380537131 -0.0623995000299712 0.955958804560379
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lecorguille
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lecorguille
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6755 M554T3314 553.5 553.5 553.5 3313.83098308557 3313.83098308557 3313.83098308557 1 0 1 558 4.31177116091939 0.748217584265479 0.580968091317849
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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6762 M554T3186 554 554 554 3186.14437095419 3186.14437095419 3186.14437095419 1 0 1 2206 Inf 1 0.5
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6767 M554T3334 554.200012207031 554.200012207031 554.200012207031 3333.91486419605 3333.91486419605 3333.91486419605 1 0 1 15 1.30217215121167 0.383033177076896 0.749567465453936
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6772 M554T3093 554.400024414062 554.400024414062 554.400024414062 3092.7094432471 3092.7094432471 3092.7094432471 1 0 1 5374 Inf 1 0.5
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6773 M554T3716 554.400024414062 554.400024414062 554.400024414062 3715.67042009322 3715.67042009322 3715.67042009322 1 1 0 [M-H-CO2]- 599.405 17 11.2614546606509 -0.932013871184945 0.522343595470851
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6776 M554T3002 554.400024414062 554.400024414062 554.400024414062 3002.02396257416 3002.02396257416 3002.02396257416 1 1 0 4094 Inf -1 0.5
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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6803 M556T3699 555.799987792969 555.799987792969 555.799987792969 3698.53175380367 3698.53175380367 3698.53175380367 1 1 0 4192 Inf -1 0.5
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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6831 M557T3943 556.600036621094 556.600036621094 556.600036621094 3943.29195691142 3943.29195691142 3943.29195691142 1 1 0 4169 Inf -1 0.5
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6832 M557T4172 556.600036621094 556.600036621094 556.600036621094 4171.84658519174 4171.84658519174 4171.84658519174 1 0 1 4420 Inf 1 0.5
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6833 M557T4062 557 557 557 4061.76437473988 4061.76437473988 4061.76437473988 1 0 1 4704 Inf 1 0.5
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6839 M557T3433 557.100036621094 557.100036621094 557.100036621094 3432.99921783969 3428.5072600218 3437.49117565757 2 1 1 4918 1.26866144240088 0.169018567018283 0.882354071932049
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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6854 M557T2917 557.299987792969 557.299987792969 557.299987792969 2917.18448763091 2917.18448763091 2917.18448763091 1 0 1 [141][M+1]- 2782 1.32322333235519 0.315365299760049 0.801728280464187
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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diff changeset
6861 M557T3780 557.400024414062 557.400024414062 557.400024414062 3780.14359305867 3780.14359305867 3780.14359305867 1 0 1 [M-2H+Na]- 536.429 [M-H-CH2]- 572.411 88 92.1818748719386 1.04259227083841 0.486691263190285
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lecorguille
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6862 M557T3222 557.400024414062 557.400024414062 557.400024414062 3222.15019772111 3222.15019772111 3222.15019772111 1 0 1 4333 Inf 1 0.5
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lecorguille
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6863 M557T3359 557.400024414062 557.400024414062 557.400024414062 3358.6484060754 3358.6484060754 3358.6484060754 1 0 1 710 3.24148555863733 0.690691803480265 0.614757983379788
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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6866 M558T4104 557.5 557.5 557.5 4103.63794309349 4103.63794309349 4103.63794309349 1 0 1 6177 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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6867 M558T3500 557.5 557.5 557.5 3499.5907337547 3499.5907337547 3499.5907337547 1 0 1 3394 2.1752059859359 0.490884193263126 0.689196290524653
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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6869 M558T2803 557.5 557.5 557.5 2802.63101261762 2802.63101261762 2802.63101261762 1 0 1 5175 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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6870 M558T3894 557.600036621094 557.600036621094 557.600036621094 3893.85717665056 3893.85717665056 3893.85717665056 1 0 1 4910 2.80318757291066 0.638833864749975 0.6357378864751
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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6871 M558T3970 557.600036621094 557.600036621094 557.600036621094 3969.75410430907 3969.75410430907 3969.75410430907 1 0 1 1990 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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6872 M558T4094 557.700012207031 557.700012207031 557.700012207031 4094.33528157085 4094.33528157085 4094.33528157085 1 0 1 5110 Inf 1 0.5
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lecorguille
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6873 M558T2688 557.900024414062 557.900024414062 557.900024414062 2687.58718990559 2687.58718990559 2687.58718990559 1 0 1 674 1.61943529125103 0.325452425136371 0.78106917299817
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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6875 M558T3997 558 558 558 3997.30497933253 3997.30497933253 3997.30497933253 1 1 0 5447 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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6878 M558T4122 558 558 558 4122.17726376076 4122.17726376076 4122.17726376076 1 1 0 1736 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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6880 M558T3573 558.100036621094 558.100036621094 558.100036621094 3572.68162114544 3572.68162114544 3572.68162114544 1 1 0 27 Inf -1 0.5
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lecorguille
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lecorguille
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6882 M558T3763 558.100036621094 558.100036621094 558.100036621094 3762.71208577947 3762.71208577947 3762.71208577947 1 0 1 951 Inf 1.2585352829932 0.427441744946421
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lecorguille
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6883 M558T4138 558.100036621094 558.100036621094 558.100036621094 4137.84320879208 4137.84320879208 4137.84320879208 1 1 0 3952 2.6206586073923 -1.19943217632093 0.407374103678426
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lecorguille
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6884 M558T3708 558.200012207031 558.200012207031 558.200012207031 3708.1445343506 3706.14258814535 3711.01029870863 3 2 1 [142][M]- [M-2H+Na]- 537.212 17 2.02666492104813 -2.17590048689322 0.234784332726746
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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6888 M558T3388 558.200012207031 558.200012207031 558.200012207031 3387.88917276548 3387.88917276548 3387.88917276548 1 0 1 461 4.54073145933936 0.935149553551492 0.520537085236739
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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6889 M558T3454 558.299987792969 558.299987792969 558.299987792969 3453.96853558916 3453.96853558916 3453.96853558916 1 1 0 1255 2.04436522986191 -0.458893022473947 0.70557319849111
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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6890 M558T2911 558.299987792969 558.299987792969 558.299987792969 2911.14152217637 2911.14152217637 2911.14152217637 1 0 1 [141][M+2]- 2783 1.11346005463576 0.114430557149525 0.919927663982272
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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6891 M558T3782 558.299987792969 558.299987792969 558.299987792969 3781.72876897582 3781.72876897582 3781.72876897582 1 0 1 88 3.18246079220416 1.59072697496287 0.33537794215088
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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6892 M558T3681 558.400024414062 558.400024414062 558.400024414062 3681.31868571187 3681.31868571187 3681.31868571187 1 1 0 613 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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6893 M558T3840 558.400024414062 558.400024414062 558.400024414062 3840.24749080167 3840.24749080167 3840.24749080167 1 0 1 3172 1.20325200345411 0.168702976792829 0.893494814445254
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
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6895 M558T3115 558.400024414062 558.400024414062 558.400024414062 3114.61301823126 3114.61301823126 3114.61301823126 1 1 0 5977 Inf -1 0.5
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6896 M558T3872 558.5 558.5 558.5 3871.61760458813 3871.61760458813 3871.61760458813 1 1 0 2753 Inf -1 0.5
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lecorguille
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6897 M558T3935 558.5 558.5 558.5 3935.24794838316 3935.24794838316 3935.24794838316 1 0 1 4170 Inf 1 0.5
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6898 M558T3339 558.5 558.5 558.5 3338.56144684373 3338.56144684373 3338.56144684373 1 0 1 1123 2.8092262948491 0.606735227634021 0.635575336513006
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6899 M559T2723 558.799987792969 558.799987792969 558.799987792969 2723.29675472651 2723.29675472651 2723.29675472651 1 0 1 2528 5.25008640710568 0.7952299962879 0.564889695604674
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6923 M559T4069 559.400024414062 559.400024414062 559.400024414062 4068.55467940059 4068.55467940059 4068.55467940059 1 1 0 3908 Inf -1 0.5
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6926 M559T3180 559.400024414062 559.400024414062 559.400024414062 3179.96275390057 3179.96275390057 3179.96275390057 1 0 1 2207 Inf 1 0.5
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6927 M559T4182 559.400024414062 559.400024414062 559.400024414062 4181.84656269688 4181.84656269688 4181.84656269688 1 1 0 6026 2.71572832849142 -0.72310565072558 0.570313914078619
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lecorguille
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6928 M560T3892 559.5 559.5 559.5 3892.28021041121 3892.28021041121 3892.28021041121 1 0 1 4911 9.03067320190829 1.37105054525218 0.391633717410781
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lecorguille
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6929 M560T2686 559.5 559.5 559.5 2685.68075810517 2685.68075810517 2685.68075810517 1 0 1 675 Inf 1 0.5
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6931 M560T3315 559.5 559.5 559.5 3315.37491849915 3315.37491849915 3315.37491849915 1 0 1 559 Inf 1 0.5
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6934 M560T2891 559.600036621094 559.600036621094 559.600036621094 2890.66347406525 2890.66347406525 2890.66347406525 1 0 1 3845 Inf 1 0.5
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lecorguille
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6937 M560T2707 559.700012207031 559.700012207031 559.700012207031 2706.96523737293 2706.96523737293 2706.96523737293 1 0 1 4879 Inf 1 0.5
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6938 M560T2631 559.700012207031 559.700012207031 559.700012207031 2631.3557021491 2631.3557021491 2631.3557021491 1 0 1 2681 1.47092260271646 0.264763332675375 0.81889662711399
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6950 M560T3953 560.100036621094 560.100036621094 560.100036621094 3952.82321264785 3952.82321264785 3952.82321264785 1 1 0 5463 1.54083070729231 -1.13465398387389 0.413533331088778
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6954 M560T3856 560.200012207031 560.200012207031 560.200012207031 3856.21608781489 3856.21608781489 3856.21608781489 1 1 0 [M+Cl+CF3COOH]- 391.234 21 1.68586152342955 -0.442313541603977 0.71141895439618
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6955 M560T2953 560.299987792969 560.299987792969 560.299987792969 2952.96860923202 2952.96860923202 2952.96860923202 1 0 1 3203 Inf 1 0.5
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6956 M560T3315 560.400024414062 560.400024414062 560.400024414062 3315.00429010249 3315.00429010249 3315.00429010249 1 1 0 [144][M]- 4 65.0329920758386 -0.989857185771077 0.503235922218362
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6957 M560T4119 560.400024414062 560.400024414062 560.400024414062 4118.91791660954 4118.91791660954 4118.91791660954 1 1 0 4571 6.58180572432238 -0.838443929388931 0.55074434003085
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6958 M560T4073 560.5 560.5 560.5 4073.28143227952 4073.28143227952 4073.28143227952 1 1 0 3909 Inf -1 0.5
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6959 M560T2963 560.5 560.5 560.5 2963.26791348294 2963.26791348294 2963.26791348294 1 1 0 3236 Inf -1.15070490680589 0.455463366761567
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6960 M561T2952 560.600036621094 560.600036621094 560.600036621094 2951.69908247012 2951.69908247012 2951.69908247012 1 1 0 3175 Inf -1 0.5
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6961 M561T2551 560.799987792969 560.799987792969 560.799987792969 2550.64208488001 2550.64208488001 2550.64208488001 1 0 1 5169 Inf 1 0.5
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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6980 M561T3857 561.400024414062 561.400024414062 561.400024414062 3857.42745413221 3857.42745413221 3857.42745413221 1 1 0 21 Inf -1 0.5
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lecorguille
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6981 M561T3149 561.400024414062 561.400024414062 561.400024414062 3148.84846331748 3148.84846331748 3148.84846331748 1 1 0 3048 2.80012585547604 -0.605423709868133 0.636134026830782
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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6985 M562T4136 561.5 561.5 561.5 4136.27730756024 4136.27730756024 4136.27730756024 1 1 0 99 7.39471178848704 -1.03901255455984 0.480689796380995
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lecorguille
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lecorguille
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6987 M562T3959 561.5 561.5 561.5 3958.98581795771 3958.98581795771 3958.98581795771 1 1 0 231 Inf -2.36814991513515 0.254365581373261
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lecorguille
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lecorguille
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6989 M562T4332 561.600036621094 561.600036621094 561.600036621094 4332.35774443202 4332.35774443202 4332.35774443202 1 0 1 348 1.56896551724147 0.3058047264185 0.793098769077596
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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6992 M562T2729 561.799987792969 561.799987792969 561.799987792969 2729.46044270343 2729.46044270343 2729.46044270343 1 1 0 2529 Inf -1 0.5
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lecorguille
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6993 M562T2611 561.799987792969 561.799987792969 561.799987792969 2610.67797459635 2610.67797459635 2610.67797459635 1 1 0 4020 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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6995 M562T3181 561.799987792969 561.799987792969 561.799987792969 3181.37964662454 3181.37964662454 3181.37964662454 1 0 1 2208 6.18823892157376 0.827666131232239 0.554225255607027
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7001 M562T3575 562 562 562 3575.3972144304 3575.3972144304 3575.3972144304 1 0 1 1681 Inf 1.51743315091907 0.37094651444866
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lecorguille
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7002 M562T3598 562 562 562 3598.13100528512 3598.13100528512 3598.13100528512 1 1 0 1460 Inf -1 0.5
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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7013 M562T4301 562.299987792969 562.299987792969 562.299987792969 4300.62940158956 4300.62940158956 4300.62940158956 1 1 0 337 1.21530249110321 -0.247452041641893 0.841681711403024
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lecorguille
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7014 M562T3638 562.299987792969 562.299987792969 562.299987792969 3638.09766475263 3638.09766475263 3638.09766475263 1 1 0 2846 3.21662855498919 -0.658048875731579 0.614524729051418
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lecorguille
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7015 M562T3771 562.299987792969 562.299987792969 562.299987792969 3770.57337551947 3770.57337551947 3770.57337551947 1 0 1 941 Inf 1.8160938886324 0.320428907828322
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lecorguille
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7016 M562T2526 562.299987792969 562.299987792969 562.299987792969 2526.17097459635 2526.17097459635 2526.17097459635 1 1 0 5960 1.8364910112036 -0.653618509288396 0.590005491532467
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lecorguille
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7017 M562T3360 562.400024414062 562.400024414062 562.400024414062 3360.1798016686 3360.1798016686 3360.1798016686 1 1 0 698 6.47499026809904 -0.83565242049453 0.551643252855618
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lecorguille
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7018 M562T3210 562.400024414062 562.400024414062 562.400024414062 3209.93814463233 3209.93814463233 3209.93814463233 1 0 1 4334 17.2176215435456 0.940335292020207 0.5187261739719
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lecorguille
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7019 M562T2789 562.400024414062 562.400024414062 562.400024414062 2789.06120506784 2789.06120506784 2789.06120506784 1 1 0 927 22.3366568978842 -2.43426725652291 0.24296767515886
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lecorguille
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lecorguille
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7022 M562T4136 562.5 562.5 562.5 4136.24529906271 4136.24529906271 4136.24529906271 1 1 0 [M+Cl+NaCOOH]- 459.535 [M-H+NaCOOH]- 495.51 99 4.07446715972944 -1.27786860394402 0.373115060913586
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7023 M562T3829 562.5 562.5 562.5 3829.21077380534 3829.21077380534 3829.21077380534 1 0 1 1895 Inf 1 0.5
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lecorguille
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7024 M563T3697 562.600036621094 562.600036621094 562.600036621094 3696.96417543909 3696.96417543909 3696.96417543909 1 1 0 5487 3.5340196753921 -0.964328605006187 0.497320731997807
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7038 M563T3752 563.299987792969 563.299987792969 563.299987792969 3751.87435231748 3751.87435231748 3751.87435231748 1 0 1 14 Inf 1 0.5
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lecorguille
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7039 M563T3578 563.299987792969 563.299987792969 563.299987792969 3577.74168998622 3577.74168998622 3577.74168998622 1 0 1 [M-H-H20]- 582.311 1628 1.66345753798602 0.341829923785399 0.771209951588868
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7041 M563T3653 563.400024414062 563.400024414062 563.400024414062 3652.85708680252 3652.85708680252 3652.85708680252 1 1 0 2411 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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7044 M563T3822 563.400024414062 563.400024414062 563.400024414062 3821.65302052574 3821.65302052574 3821.65302052574 1 1 0 [M-2H+Na]- 542.429 [M-H-CH2]- 578.411 33 1.15876868246692 0.103729514217096 0.927027580781896
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7050 M564T2822 563.5 563.5 563.5 2822.34220338741 2822.34220338741 2822.34220338741 1 1 0 3311 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7052 M564T2553 563.600036621094 563.600036621094 563.600036621094 2552.77497459635 2552.77497459635 2552.77497459635 1 1 0 3093 Inf -3.0479776024738 0.201821776436814
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7054 M564T2880 564 564 564 2879.67504182271 2879.67504182271 2879.67504182271 1 0 1 4722 Inf 1 0.5
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lecorguille
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7055 M564T2714 564 564 564 2714.01060280537 2714.01060280537 2714.01060280537 1 1 0 2530 Inf -1.47504145156489 0.379279913423598
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7056 M564T3701 564.100036621094 564.100036621094 564.100036621094 3701.23529883703 3701.23529883703 3701.23529883703 1 0 1 4193 1.04813008380003 0.0470451043334846 0.969567686522717
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7057 M564T3769 564.100036621094 564.100036621094 564.100036621094 3769.04864210834 3769.04864210834 3769.04864210834 1 0 1 955 1.69691153025297 0.690076645893222 0.611844936847906
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7058 M564T3443 564.200012207031 564.200012207031 564.200012207031 3442.65859992447 3438.75373296649 3446.56346688244 2 1 1 [145][M]- 62 1.36808633181212 1.32726765020923 0.395955456483222
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7059 M564T4167 564.200012207031 564.200012207031 564.200012207031 4166.6216435323 4166.6216435323 4166.6216435323 1 0 1 5936 1.08558212405345 0.0765670596101253 0.950311396524349
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7060 M564T3265 564.299987792969 564.299987792969 564.299987792969 3264.50139718949 3264.50139718949 3264.50139718949 1 0 1 3610 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7061 M564T3498 564.299987792969 564.299987792969 564.299987792969 3497.52601750309 3497.52601750309 3497.52601750309 1 0 1 3397 1.96296909196917 0.437115413956507 0.717112922648422
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7062 M564T3049 564.299987792969 564.299987792969 564.299987792969 3049.20285860981 3049.20285860981 3049.20285860981 1 0 1 3501 1.27363880872156 0.476406879519919 0.684755220905279
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7063 M564T3866 564.299987792969 564.299987792969 564.299987792969 3865.67503918027 3865.67503918027 3865.67503918027 1 1 0 [M-2H+Na]- 543.329 21 1.3159770206641 0.332616099243132 0.794524935477479
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7066 M564T3143 564.299987792969 564.299987792969 564.299987792969 3142.59911125088 3142.59911125088 3142.59911125088 1 1 0 3124 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7067 M564T2823 564.299987792969 564.299987792969 564.299987792969 2823.0524476356 2823.0524476356 2823.0524476356 1 0 1 3328 22.8176079944652 1.20526678514971 0.439982670461415
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7068 M564T3467 564.299987792969 564.299987792969 564.299987792969 3466.85812724904 3466.85812724904 3466.85812724904 1 1 0 66 Inf -1.06878661118986 0.4788403552078
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7069 M564T4138 564.400024414062 564.400024414062 564.400024414062 4137.84320879208 4136.64576660025 4140.86019981259 3 1 2 [146][M]- [M+Cl]- 529.429 [M-H]- 565.411 99 1.01354519108472 0.0535070586558501 0.962500239379098
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7070 M564T4461 564.400024414062 564.400024414062 564.400024414062 4460.57322276304 4460.57322276304 4460.57322276304 1 1 0 6243 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7071 M564T3837 564.400024414062 564.400024414062 564.400024414062 3836.71587414289 3836.71587414289 3836.71587414289 1 1 0 3158 3.13968290912787 -2.1326879931862 0.276571045763222
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7072 M564T3288 564.400024414062 564.400024414062 564.400024414062 3287.55118520376 3287.55118520376 3287.55118520376 1 0 1 38 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7073 M564T3737 564.400024414062 564.400024414062 564.400024414062 3737.40215453346 3737.40215453346 3737.40215453346 1 0 1 5202 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7074 M564T4284 564.5 564.5 564.5 4283.73322276304 4283.73322276304 4283.73322276304 1 1 0 347 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7075 M564T4151 564.5 564.5 564.5 4150.84085356425 4150.84085356425 4150.84085356425 1 0 1 6050 13.3807757197368 0.925190234003727 0.524685053552949
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7076 M564T4208 564.5 564.5 564.5 4208.29196115092 4208.29196115092 4208.29196115092 1 1 0 140 4.28878038377463 -0.991388557287725 0.479934987941073
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7077 M565T2853 564.600036621094 564.600036621094 564.600036621094 2853.35893667944 2853.35893667944 2853.35893667944 1 1 0 4252 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7078 M565T4413 564.600036621094 564.600036621094 564.600036621094 4412.83815089905 4412.83815089905 4412.83815089905 1 0 1 6123 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7079 M565T2709 564.799987792969 564.799987792969 564.799987792969 2708.60784018435 2708.60784018435 2708.60784018435 1 0 1 225 1.2351483256404 0.217851991640737 0.856334147804266
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7080 M565T2964 564.799987792969 564.799987792969 564.799987792969 2964.19029619544 2964.19029619544 2964.19029619544 1 1 0 3281 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7081 M565T2632 564.799987792969 564.799987792969 564.799987792969 2631.63156617644 2631.63156617644 2631.63156617644 1 1 0 2684 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7082 M565T2541 564.900024414062 564.900024414062 564.900024414062 2540.54828676082 2540.54828676082 2540.54828676082 1 1 0 5562 23.3398345306458 -2.69011721616503 0.220784548059755
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lecorguille
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7083 M565T2686 564.900024414062 564.900024414062 564.900024414062 2685.68075810517 2685.68075810517 2685.68075810517 1 0 1 676 1.66356804588529 0.372852195665089 0.761474046336375
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7102 M566T2850 565.5 565.5 565.5 2849.78952867535 2849.78952867535 2849.78952867535 1 0 1 5773 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7103 M566T2522 565.5 565.5 565.5 2521.622668269 2521.622668269 2521.622668269 1 0 1 5061 6.74647887323944 0.842568867694167 0.54941928693541
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7104 M566T2802 565.5 565.5 565.5 2801.54396090667 2801.54396090667 2801.54396090667 1 0 1 5192 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7105 M566T3606 565.5 565.5 565.5 3605.88292424392 3605.88292424392 3605.88292424392 1 1 0 1439 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7107 M566T2558 565.5 565.5 565.5 2557.616668269 2557.616668269 2557.616668269 1 0 1 3094 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7108 M566T3277 565.900024414062 565.900024414062 565.900024414062 3276.55852937273 3276.55852937273 3276.55852937273 1 0 1 1250 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7110 M566T2788 566 566 566 2788.02229392021 2788.02229392021 2788.02229392021 1 0 1 928 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7111 M566T2705 566.100036621094 566.100036621094 566.100036621094 2705.32368854496 2705.32368854496 2705.32368854496 1 0 1 4881 8.88376601837016 0.881865718560306 0.536959228317556
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7128 M567T2913 566.600036621094 566.600036621094 566.600036621094 2912.8908895169 2912.8908895169 2912.8908895169 1 1 0 [M+Cl]- 531.631 56 6.22636794877258 -1.31491033169382 0.394050942958643
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7133 M567T3279 566.900024414062 566.900024414062 566.900024414062 3278.66099664615 3278.66099664615 3278.66099664615 1 0 1 18 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7136 M567T3008 567.200012207031 567.200012207031 567.200012207031 3008.32365642662 3008.32365642662 3008.32365642662 1 0 1 37 8.56905958464513 0.920682930666457 0.525342245730997
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7137 M567T3317 567.299987792969 567.299987792969 567.299987792969 3316.58199034973 3316.58199034973 3316.58199034973 1 1 0 560 2.01448588696873 -0.708523058127855 0.552108478039493
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7138 M567T3090 567.299987792969 567.299987792969 567.299987792969 3089.88278083144 3089.88278083144 3089.88278083144 1 1 0 5375 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7139 M567T4132 567.299987792969 567.299987792969 567.299987792969 4131.55437805172 4131.55437805172 4131.55437805172 1 0 1 [M+Cl]- 532.325 [2M-H+Cl]2- 550.31 23 1.7087059458937 0.538242295639601 0.683932619542064
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7140 M567T4228 567.400024414062 567.400024414062 567.400024414062 4227.52320077638 4225.03082937669 4228.64140158956 3 1 2 [147][M+1]- 5416 1.41423827406034 0.639134711101654 0.589103399425579
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7141 M567T3692 567.400024414062 567.400024414062 567.400024414062 3692.26549459042 3692.26549459042 3692.26549459042 1 1 0 [148][M]- 615 13.6516767725817 -0.926748764148055 0.524191307209387
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7142 M567T2660 567.400024414062 567.400024414062 567.400024414062 2660.47424523347 2660.47424523347 2660.47424523347 1 1 0 2275 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7143 M567T3937 567.400024414062 567.400024414062 567.400024414062 3936.81565274677 3936.81565274677 3936.81565274677 1 0 1 4171 18.3278584982936 0.945423968814382 0.517847128634375
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7144 M567T3503 567.400024414062 567.400024414062 567.400024414062 3503.05711300005 3503.05711300005 3503.05711300005 1 1 0 3364 3.29145559196632 -2.24985610481446 0.25225801756544
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7145 M568T4237 567.5 567.5 567.5 4236.89574443202 4236.89574443202 4236.89574443202 1 0 1 5790 3.72721093936055 1.76597580683157 0.237219392722527
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7146 M568T3878 567.5 567.5 567.5 3877.89379459742 3877.89379459742 3877.89379459742 1 1 0 2754 Inf -1.42166449444605 0.390250952506144
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7147 M568T2973 567.5 567.5 567.5 2972.99959761349 2972.99959761349 2972.99959761349 1 0 1 3283 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7148 M568T2942 567.5 567.5 567.5 2942.13826084613 2942.13826084613 2942.13826084613 1 0 1 2822 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7149 M568T2675 567.799987792969 567.799987792969 567.799987792969 2674.90732833963 2674.90732833963 2674.90732833963 1 0 1 677 5.80340040994101 0.815666546523285 0.558135477994148
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7150 M568T2542 567.799987792969 567.799987792969 567.799987792969 2542.11328676082 2542.11328676082 2542.11328676082 1 1 0 5170 4.09106830122575 -0.733956767347886 0.586017911383537
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7151 M568T2804 567.900024414062 567.900024414062 567.900024414062 2803.78419580111 2803.78419580111 2803.78419580111 1 1 0 5193 Inf -19.6294182710409 0.0324039094230888
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7152 M568T2534 567.900024414062 567.900024414062 567.900024414062 2534.28828676082 2534.28828676082 2534.28828676082 1 1 0 5897 4.30727242482748 -0.747941720942918 0.581064956448943
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7153 M568T3505 568 568 568 3504.6342853155 3504.6342853155 3504.6342853155 1 1 0 3398 Inf -1.91637166594526 0.306182539479751
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7154 M568T3029 568 568 568 3028.84860419489 3028.84860419489 3028.84860419489 1 0 1 39 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7155 M568T3490 568.100036621094 568.100036621094 568.100036621094 3489.87194594823 3489.87194594823 3489.87194594823 1 0 1 1812 1.62192808393167 0.874837605952004 0.536312237667931
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7156 M568T2866 568.100036621094 568.100036621094 568.100036621094 2865.83719765532 2865.83719765532 2865.83719765532 1 1 0 3655 1.51190613210704 -0.367760940731135 0.761444508395493
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7157 M568T3957 568.100036621094 568.100036621094 568.100036621094 3956.93670548455 3956.93670548455 3956.93670548455 1 0 1 5400 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7158 M568T4238 568.100036621094 568.100036621094 568.100036621094 4238.03140158956 4238.03140158956 4238.03140158956 1 1 0 5791 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7159 M568T4122 568.100036621094 568.100036621094 568.100036621094 4122.45552011977 4122.45552011977 4122.45552011977 1 0 1 1737 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7160 M568T3197 568.200012207031 568.200012207031 568.200012207031 3196.78846837745 3191.10880924737 3202.01360236328 4 2 2 [149][M]- 30 1.43076420653772 3.6348622164699 0.170913924599986
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7161 M568T3250 568.200012207031 568.200012207031 568.200012207031 3249.98499070393 3245.66276251549 3254.30721889237 2 0 2 [M+Cl]- 533.231 34 1.31708299411049 4.1437306036026 0.135628188036995
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7162 M568T2911 568.200012207031 568.200012207031 568.200012207031 2911.14152217637 2911.14152217637 2911.14152217637 1 0 1 2786 1.75109980762187 0.411695199617112 0.743247784277527
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7163 M568T3614 568.299987792969 568.299987792969 568.299987792969 3613.64356598996 3609.2072731903 3616.23699063786 3 2 1 [150][M]- 51 5.21627752360765 -1.18272287676962 0.446124304147639
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7164 M568T4226 568.299987792969 568.299987792969 568.299987792969 4225.51010090249 4225.51010090249 4225.51010090249 1 1 0 [151][M]- 171 1.06400326376583 -0.0477830965635735 0.966493134887789
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7165 M568T3307 568.299987792969 568.299987792969 568.299987792969 3307.00627849836 3307.00627849836 3307.00627849836 1 0 1 561 6.90728433862288 0.846401138332704 0.548191591234422
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7166 M568T2628 568.299987792969 568.299987792969 568.299987792969 2628.03802468566 2628.03802468566 2628.03802468566 1 1 0 2686 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7167 M568T2914 568.299987792969 568.299987792969 568.299987792969 2914.42997824767 2914.42997824767 2914.42997824767 1 1 0 [M+Cl+NaCOOH]- 465.335 [M-H+NaCOOH]- 501.31 56 2.28156998138899 -0.654584511406514 0.605954700504516
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7168 M568T3461 568.400024414062 568.400024414062 568.400024414062 3460.67099542738 3460.67099542738 3460.67099542738 1 1 0 1297 4.3346413525473 -0.749610978041771 0.580479305568277
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7169 M568T4229 568.400024414062 568.400024414062 568.400024414062 4229.07074443202 4229.07074443202 4229.07074443202 1 0 1 [147][M+2]- 171 1.7652551475915 1.75808337942349 0.275696011093316
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7170 M568T3119 568.400024414062 568.400024414062 568.400024414062 3119.26381619664 3119.26381619664 3119.26381619664 1 1 0 5035 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7171 M568T2776 568.400024414062 568.400024414062 568.400024414062 2775.7539022167 2775.7539022167 2775.7539022167 1 1 0 151 4.06373670486433 -0.732081298076544 0.586688594848234
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7172 M568T3788 568.400024414062 568.400024414062 568.400024414062 3788.06929478123 3788.06929478123 3788.06929478123 1 0 1 4445 2.13216621360993 0.510855550855557 0.685358887271267
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7173 M568T3691 568.400024414062 568.400024414062 568.400024414062 3690.69884839 3690.69884839 3690.69884839 1 1 0 [148][M+1]- 5 15.5543130492561 -0.994766360860313 0.501594252160052
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7174 M568T3688 568.5 568.5 568.5 3687.71946612331 3687.71946612331 3687.71946612331 1 0 1 616 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7175 M568T3157 568.5 568.5 568.5 3156.6778024024 3156.6778024024 3156.6778024024 1 1 0 820 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7176 M568T2567 568.5 568.5 568.5 2567.15228676082 2567.15228676082 2567.15228676082 1 1 0 5868 7.24095262006366 -0.853793078290496 0.545832132859072
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7177 M569T2621 568.799987792969 568.799987792969 568.799987792969 2620.96079482671 2618.50297459635 2623.41861505708 2 1 1 2687 2.05196461220416 0.622732899861801 0.601912715122086
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7178 M569T3448 568.799987792969 568.799987792969 568.799987792969 3448.14363826274 3448.14363826274 3448.14363826274 1 1 0 62 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7179 M569T2893 568.900024414062 568.900024414062 568.900024414062 2893.43940086615 2893.43940086615 2893.43940086615 1 0 1 3846 3.41124554559915 0.678307134246845 0.606627856619097
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7180 M569T2540 569 569 569 2540.401668269 2540.401668269 2540.401668269 1 0 1 5555 6.33426388527928 1.93248687654964 0.257264447018828
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7181 M569T2866 569 569 569 2865.52098715007 2865.52098715007 2865.52098715007 1 0 1 3656 Inf 1.28080271401737 0.422014526717133
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7182 M569T2918 569 569 569 2917.53423460288 2917.53423460288 2917.53423460288 1 0 1 2787 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7183 M569T3367 569 569 569 3367.3903555858 3367.3903555858 3367.3903555858 1 0 1 126 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7184 M569T3984 569 569 569 3984.11092292181 3984.11092292181 3984.11092292181 1 1 0 4510 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7185 M569T2864 569.100036621094 569.100036621094 569.100036621094 2864.2742125128 2864.2742125128 2864.2742125128 1 1 0 3657 3.82050044613252 -0.714194408045063 0.593165369507409
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7186 M569T4102 569.100036621094 569.100036621094 569.100036621094 4101.80079484156 4101.80079484156 4101.80079484156 1 1 0 5816 Inf -29.5775923380461 0.0215155230850801
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7187 M569T4042 569.100036621094 569.100036621094 569.100036621094 4041.57469763103 4041.57469763103 4041.57469763103 1 0 1 5314 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7188 M569T3197 569.200012207031 569.200012207031 569.200012207031 3196.78846837745 3192.67421395795 3202.01360236328 4 2 2 [149][M+1]- 30 1.41635045215802 3.78199811629426 0.147700537540613
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7189 M569T3504 569.200012207031 569.200012207031 569.200012207031 3504.06063145367 3504.06063145367 3504.06063145367 1 1 0 [M-2H+Na]- 548.212 76 1.78942629297583 -0.910305670693801 0.518410665038909
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7190 M569T2698 569.200012207031 569.200012207031 569.200012207031 2697.66327660635 2697.66327660635 2697.66327660635 1 1 0 5075 1.22697380381612 -0.342041360703518 0.783296537058604
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7191 M569T4179 569.200012207031 569.200012207031 569.200012207031 4179.24904985862 4179.24904985862 4179.24904985862 1 0 1 4421 1.80045571498806 0.435812323047 0.733965729117116
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7192 M569T4228 569.299987792969 569.299987792969 569.299987792969 4228.40777624431 4228.17415089905 4228.64140158956 2 1 1 [151][M+1]- 5431 1.0816771039523 0.0718570000504098 0.952747511036424
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7193 M569T3611 569.299987792969 569.299987792969 569.299987792969 3611.42541959013 3609.2072731903 3613.64356598996 2 2 0 [150][M+1]- 51 5.40885045110343 -1.23403099994928 0.433516828259293
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7194 M569T3780 569.299987792969 569.299987792969 569.299987792969 3780.14359305867 3780.14359305867 3780.14359305867 1 0 1 88 2.79156007171373 0.69728843949825 0.611937077786688
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7195 M569T3171 569.299987792969 569.299987792969 569.299987792969 3170.77753924381 3170.77753924381 3170.77753924381 1 1 0 745 1.07281133069826 -0.119417205319228 0.921892431921565
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7196 M569T3794 569.400024414062 569.400024414062 569.400024414062 3793.87289826827 3789.65430237007 3798.09149416646 2 1 1 5407 1.10849904514587 0.0757587381299332 0.946510971961744
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7197 M569T3760 569.400024414062 569.400024414062 569.400024414062 3759.66571973942 3759.66571973942 3759.66571973942 1 0 1 935 7.3089146587618 2.4802310086677 0.240387379588944
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7198 M569T3691 569.400024414062 569.400024414062 569.400024414062 3690.87159551378 3690.87159551378 3690.87159551378 1 1 0 [148][M+2]- 627 3.93642452049446 -2.5328967072787 0.158790771552546
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7199 M569T2747 569.400024414062 569.400024414062 569.400024414062 2746.52752074663 2746.52752074663 2746.52752074663 1 0 1 4364 4.20166680243049 0.741293344704183 0.583409105199133
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7200 M570T2712 569.5 569.5 569.5 2711.57727406938 2711.57727406938 2711.57727406938 1 1 0 2532 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7201 M570T2898 569.5 569.5 569.5 2897.94212950607 2897.94212950607 2897.94212950607 1 1 0 4783 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7202 M570T3941 569.5 569.5 569.5 3941.16625793116 3941.16625793116 3941.16625793116 1 0 1 4172 3.56876855030395 1.21719671534725 0.378123805670911
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7203 M570T3637 569.5 569.5 569.5 3637.35902306758 3637.35902306758 3637.35902306758 1 0 1 2857 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7204 M570T4103 569.5 569.5 569.5 4103.18433006527 4103.18433006527 4103.18433006527 1 1 0 6178 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7205 M570T4078 569.5 569.5 569.5 4078.279061465 4078.279061465 4078.279061465 1 1 0 3910 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7206 M570T2893 569.600036621094 569.600036621094 569.600036621094 2892.58722465327 2892.58722465327 2892.58722465327 1 1 0 95 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7207 M570T2761 569.700012207031 569.700012207031 569.700012207031 2761.41308680454 2761.41308680454 2761.41308680454 1 0 1 3814 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
7209 M570T2919 569.799987792969 569.799987792969 569.799987792969 2919.04838573748 2919.04838573748 2919.04838573748 1 1 0 56 1024.94599566422 -1.00208548567273 0.499336606950729
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
7211 M570T3287 570 570 570 3286.54221079343 3286.54221079343 3286.54221079343 1 0 1 3797 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
7212 M570T3052 570.100036621094 570.100036621094 570.100036621094 3051.82258433502 3047.63518465713 3056.0099840129 2 1 1 [152][M]- [M-2H+Na]- 549.112 [M-H]- 571.112 81 1.49247950488862 0.282215414858782 0.808042653715397
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
7213 M570T3104 570.100036621094 570.100036621094 570.100036621094 3103.74459948594 3099.07166399095 3108.41753498094 2 1 1 [153][M]- [M-H]- 571.112 68 1.64246000102652 0.409542058107211 0.732461743299891
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
7214 M570T3650 570.100036621094 570.100036621094 570.100036621094 3649.75436085664 3649.75436085664 3649.75436085664 1 1 0 1526 11.8661720305616 -1.88417513925803 0.2993272891737
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
7215 M570T3519 570.100036621094 570.100036621094 570.100036621094 3518.81181544796 3518.81181544796 3518.81181544796 1 1 0 429 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
7216 M570T2542 570.100036621094 570.100036621094 570.100036621094 2541.81997459635 2541.81997459635 2541.81997459635 1 1 0 5556 2.08937010775257 -0.564233147581743 0.639829357463063
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
7217 M570T3132 570.200012207031 570.200012207031 570.200012207031 3132.1092416445 3132.1092416445 3132.1092416445 1 0 1 5003 Inf 1.58687867835816 0.35797570823539
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7218 M570T3498 570.299987792969 570.299987792969 570.299987792969 3497.95028595429 3495.99683372091 3499.90373818767 2 1 1 [M-2H+Na]- 549.312 76 2.52571477419942 -0.59927315985362 0.65376421220146
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
7219 M570T4122 570.299987792969 570.299987792969 570.299987792969 4122.12184262002 4122.06642147928 4122.17726376076 2 2 0 [154][M]- 29 3.2628883784924 -2.06119484688728 0.187875978338218
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
7220 M570T3615 570.299987792969 570.299987792969 570.299987792969 3615.18616174967 3615.18616174967 3615.18616174967 2 1 0 [150][M+2]- 51 2.12277113723853 -0.906215771573952 0.517324356776932
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
7221 M570T3169 570.299987792969 570.299987792969 570.299987792969 3169.04072732697 3169.04072732697 3169.04072732697 1 0 1 798 6.91213515628258 0.84651388211985 0.548155520326937
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7222 M570T4132 570.400024414062 570.400024414062 570.400024414062 4131.55437805172 4125.60853704554 4131.57917077552 3 1 2 [155][M]- [M+Cl]- 535.431 23 1.20291907348714 0.325447447970818 0.797028064069492
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7223 M570T3504 570.400024414062 570.400024414062 570.400024414062 3504.22462616196 3504.22462616196 3504.22462616196 1 0 1 3399 3.28863621825382 0.665821090575825 0.61146854982549
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
7224 M570T3861 570.400024414062 570.400024414062 570.400024414062 3860.94388545761 3860.94388545761 3860.94388545761 1 1 0 1424 1.35967574500374 -0.460607736513292 0.717644181134788
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
7225 M570T2751 570.400024414062 570.400024414062 570.400024414062 2750.56690040024 2750.56690040024 2750.56690040024 1 1 0 4365 2.03303895963563 -0.699908287405757 0.578676491078126
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7226 M570T3604 570.400024414062 570.400024414062 570.400024414062 3604.47159932894 3604.47159932894 3604.47159932894 1 1 0 1461 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7227 M570T3761 570.400024414062 570.400024414062 570.400024414062 3761.35736156645 3761.35736156645 3761.35736156645 1 1 0 1010 3.23935514666273 -0.66053875452136 0.613542019514536
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7228 M570T2889 570.5 570.5 570.5 2889.09562436083 2889.09562436083 2889.09562436083 1 0 1 3847 12.4546736136924 1.36273034824465 0.398374774972404
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7229 M570T3689 570.5 570.5 570.5 3689.29376228834 3689.29376228834 3689.29376228834 1 0 1 617 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
7230 M570T4141 570.5 570.5 570.5 4141.37597099195 4141.37597099195 4141.37597099195 1 0 1 4247 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7231 M571T2728 570.600036621094 570.600036621094 570.600036621094 2727.91346287142 2727.91346287142 2727.91346287142 1 1 0 2448 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
7232 M571T2903 570.600036621094 570.600036621094 570.600036621094 2903.17727640216 2903.17727640216 2903.17727640216 1 0 1 3926 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7233 M571T3515 570.600036621094 570.600036621094 570.600036621094 3514.99046491624 3514.99046491624 3514.99046491624 1 1 0 [156][M]2- 351 7.98020123951961 -0.905807077098373 0.527375786602802
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
7234 M571T2916 570.799987792969 570.799987792969 570.799987792969 2915.96882550519 2915.96882550519 2915.96882550519 1 1 0 56 12.3309088179579 -0.916505850244478 0.526440295862228
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7235 M571T2687 570.799987792969 570.799987792969 570.799987792969 2687.30875175009 2687.30875175009 2687.30875175009 1 0 1 678 2.54636764914849 0.565257337131289 0.653767536308415
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7236 M571T3494 570.900024414062 570.900024414062 570.900024414062 3493.60089329966 3493.60089329966 3493.60089329966 1 1 0 3512 Inf -11.3238705764385 0.0560738114063082
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7237 M571T3479 570.900024414062 570.900024414062 570.900024414062 3479.15909272518 3479.15909272518 3479.15909272518 1 0 1 1813 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7238 M571T3549 570.900024414062 570.900024414062 570.900024414062 3548.83214501254 3548.83214501254 3548.83214501254 1 1 0 2330 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7239 M571T3503 571 571 571 3503.10417845746 3500.58472682777 3505.62363008716 2 1 1 [M+Cl]- 536.034 [M-2H+Na]- 550.029 [M-H-CH2]- 586.011 76 7.66350778580378 -0.865527859209963 0.543686556622211
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7240 M571T2909 571 571 571 2909.41319283123 2909.41319283123 2909.41319283123 1 0 1 56 2.62693531249341 0.610041996475191 0.646455628610895
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7241 M571T2617 571 571 571 2617.084668269 2617.084668269 2617.084668269 1 0 1 5640 1.24929180264475 0.579593721956761 0.665596141354144
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7242 M571T3231 571 571 571 3230.50925543061 3230.50925543061 3230.50925543061 1 0 1 2726 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7243 M571T3391 571 571 571 3391.28651330641 3391.28651330641 3391.28651330641 1 0 1 499 4.04239959225687 1.31230156596239 0.360781391343056
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7244 M571T3170 571 571 571 3170.2573829783 3170.2573829783 3170.2573829783 1 0 1 8 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7245 M571T3102 571.100036621094 571.100036621094 571.100036621094 3102.16916416742 3097.4935938957 3106.84473443915 2 1 1 [153][M+1]- 68 1.76955422112738 0.432966629065012 0.721283046912533
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7246 M571T3053 571.100036621094 571.100036621094 571.100036621094 3052.59192711036 3047.63518465713 3057.5486695636 2 1 1 [152][M+1]- 81 1.21127506240367 0.139001542762017 0.902809781210698
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7247 M571T3517 571.100036621094 571.100036621094 571.100036621094 3516.56170641443 3516.56170641443 3516.56170641443 1 1 0 [156][M+1]2- 430 15.2916071787999 -0.958437981566805 0.512361628349215
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7248 M571T3689 571.100036621094 571.100036621094 571.100036621094 3689.35201516072 3689.35201516072 3689.35201516072 1 1 0 568 9.94844517028948 -0.894971785220491 0.532853650755302
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7249 M571T4081 571.100036621094 571.100036621094 571.100036621094 4081.47888012129 4081.47888012129 4081.47888012129 1 0 1 5729 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7250 M571T3910 571.100036621094 571.100036621094 571.100036621094 3909.62619158916 3909.62619158916 3909.62619158916 1 0 1 4786 5.77177103889802 0.825604176046649 0.560017358837894
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7251 M571T3763 571.100036621094 571.100036621094 571.100036621094 3762.78203929079 3762.78203929079 3762.78203929079 1 0 1 [157][M]- 956 1.92704020693205 0.435349874396236 0.720220725807232
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7252 M571T2733 571.200012207031 571.200012207031 571.200012207031 2732.55616682718 2732.55616682718 2732.55616682718 1 1 0 2533 Inf -1.21505311581594 0.438385529725879
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7253 M571T3918 571.200012207031 571.200012207031 571.200012207031 3917.89401957649 3917.89401957649 3917.89401957649 1 1 0 2944 1.41900944040646 -0.317677340064673 0.786728873511286
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7254 M571T2570 571.200012207031 571.200012207031 571.200012207031 2570.135668269 2570.135668269 2570.135668269 1 0 1 5299 1.46681210711729 0.31787003023807 0.803873595285239
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7255 M571T4124 571.299987792969 571.299987792969 571.299987792969 4123.74438860043 4123.74438860043 4123.74438860043 1 1 0 [154][M+1]- 1738 1.39281313674205 -0.380854164863595 0.768243659101307
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7256 M571T2723 571.299987792969 571.299987792969 571.299987792969 2723.27653495129 2723.27653495129 2723.27653495129 1 1 0 2450 6.41540641373812 -1.02967430502853 0.481043299563673
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7257 M571T3246 571.299987792969 571.299987792969 571.299987792969 3246.33080440992 3246.33080440992 3246.33080440992 1 1 0 3471 1.04513339923829 0.252487223305586 0.833327950519715
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7258 M571T3791 571.299987792969 571.299987792969 571.299987792969 3791.23922865522 3791.23922865522 3791.23922865522 1 0 1 4445 7.81428243231933 1.36584167332819 0.38927435315611
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7259 M571T4259 571.299987792969 571.299987792969 571.299987792969 4258.80474443202 4258.80474443202 4258.80474443202 1 0 1 297 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7260 M571T3158 571.299987792969 571.299987792969 571.299987792969 3158.12108870158 3158.12108870158 3158.12108870158 1 0 1 852 2.89769685747244 0.619070886373713 0.630372038562912
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7261 M571T4125 571.400024414062 571.400024414062 571.400024414062 4125.47836127181 4122.06642147928 4133.14561853743 4 2 2 [155][M+1]- 23 1.64120544888186 -2.87742902944425 0.119170067629478
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7262 M571T2780 571.400024414062 571.400024414062 571.400024414062 2780.01409031445 2774.67191534644 2785.35626528247 2 0 2 4270 15.248422095281 2.25624806454477 0.25577219486569
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7263 M571T4085 571.400024414062 571.400024414062 571.400024414062 4084.63062227959 4084.63062227959 4084.63062227959 1 0 1 5730 2.30641621363806 0.519682732718413 0.675041108406764
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7264 M571T3281 571.400024414062 571.400024414062 571.400024414062 3281.49564400442 3281.49564400442 3281.49564400442 1 1 0 1251 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7265 M571T3708 571.400024414062 571.400024414062 571.400024414062 3707.67695099937 3707.67695099937 3707.67695099937 1 1 0 17 3.07287084579567 -0.746126443035474 0.57246591481991
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7266 M571T3033 571.400024414062 571.400024414062 571.400024414062 3032.9138977851 3032.9138977851 3032.9138977851 1 1 0 2159 Inf -1.42549421431202 0.389445396892434
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7267 M571T3299 571.400024414062 571.400024414062 571.400024414062 3299.1367219701 3299.1367219701 3299.1367219701 1 0 1 2596 2.82663111293293 0.609220889307776 0.634519379899763
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7299 M572T3678 572.299987792969 572.299987792969 572.299987792969 3678.20480805793 3678.20480805793 3678.20480805793 1 1 0 3696 25.4554981355386 -1.5822380814949 0.3573257609095
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7305 M572T3675 572.400024414062 572.400024414062 572.400024414062 3674.65247842298 3674.65247842298 3674.65247842298 1 0 1 3697 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7310 M572T4182 572.5 572.5 572.5 4181.68550617079 4181.68550617079 4181.68550617079 1 1 0 6027 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7315 M573T3744 572.900024414062 572.900024414062 572.900024414062 3744.08158908687 3744.08158908687 3744.08158908687 1 0 1 1024 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7316 M573T3155 572.900024414062 572.900024414062 572.900024414062 3154.99597263236 3154.99597263236 3154.99597263236 1 0 1 229 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7319 M573T4070 573 573 573 4069.52308650706 4069.52308650706 4069.52308650706 1 0 1 3852 Inf 1 0.5
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7326 M573T4121 573.100036621094 573.100036621094 573.100036621094 4120.87908209639 4120.87908209639 4120.87908209639 1 0 1 1739 1.30336442679313 -0.184664160062309 0.871523908270978
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7328 M573T4186 573.100036621094 573.100036621094 573.100036621094 4185.76802694997 4185.76802694997 4185.76802694997 1 0 1 255 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7329 M573T3048 573.100036621094 573.100036621094 573.100036621094 3047.63518465713 3047.63518465713 3047.63518465713 1 0 1 [152][M+3]- 3502 5.20915810332706 1.0201053392406 0.492126738785051
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7330 M573T3657 573.200012207031 573.200012207031 573.200012207031 3657.1253624505 3656.14330764058 3658.10741726043 2 1 1 [158][M+1]- 47 1.21782354519173 -0.164622081447305 0.884511809942881
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7332 M573T3388 573.200012207031 573.200012207031 573.200012207031 3387.88917276548 3387.88917276548 3387.88917276548 1 0 1 3 1.19634588374978 -0.205885514641028 0.863328764256192
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7333 M573T3783 573.200012207031 573.200012207031 573.200012207031 3783.31394298599 3783.31394298599 3783.31394298599 1 0 1 88 1.62860635139088 0.492573756028634 0.703861221846453
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7334 M573T2520 573.299987792969 573.299987792969 573.299987792969 2519.91097459635 2519.91097459635 2519.91097459635 1 1 0 5062 1.41362966362253 -2.67381428460935 0.22188809656845
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7335 M573T3666 573.299987792969 573.299987792969 573.299987792969 3665.64485802011 3665.64485802011 3665.64485802011 1 0 1 [M+Cl+NaCOOH]- 470.336 [M-H+NaCOOH]- 506.311 2 Inf 1.11687241408064 0.464887902577229
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7337 M573T3615 573.299987792969 573.299987792969 573.299987792969 3615.18616174967 3615.18616174967 3615.18616174967 1 1 0 [159][M]- 51 16.1509519790032 -1.23373797513072 0.433617861007177
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7338 M573T3348 573.400024414062 573.400024414062 573.400024414062 3347.8458781399 3347.8458781399 3347.8458781399 1 0 1 739 Inf 2.26093280178754 0.265106470672877
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7339 M573T4078 573.400024414062 573.400024414062 573.400024414062 4078.279061465 4078.279061465 4078.279061465 1 1 0 3911 1.0375038670688 -0.0430764910954162 0.969567389092088
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7340 M573T3691 573.400024414062 573.400024414062 573.400024414062 3690.69884839 3690.69884839 3690.69884839 1 1 0 620 1.88218649477545 -0.586377433763395 0.617690493154781
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7341 M573T3970 573.400024414062 573.400024414062 573.400024414062 3970.30084930535 3970.30084930535 3970.30084930535 1 1 0 1982 5.96545252384936 -1.0058081608432 0.487439710268117
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7342 M574T3927 573.5 573.5 573.5 3927.41470965586 3927.41470965586 3927.41470965586 1 1 0 3022 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7343 M574T2646 573.5 573.5 573.5 2646.06874587309 2646.06874587309 2646.06874587309 1 1 0 5945 23.4266100417922 -2.06320300733974 0.284029341678499
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7344 M574T3736 573.600036621094 573.600036621094 573.600036621094 3736.02301120628 3736.02301120628 3736.02301120628 1 1 0 3587 1.85604004127539 -0.406035337862794 0.734123573682573
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7345 M574T3715 573.600036621094 573.600036621094 573.600036621094 3715.34771352901 3715.34771352901 3715.34771352901 1 0 1 1203 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7346 M574T2913 573.700012207031 573.700012207031 573.700012207031 2912.8908895169 2912.8908895169 2912.8908895169 1 1 0 56 48.9586020096776 -0.993575106394803 0.501938661997909
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7347 M574T2900 573.700012207031 573.700012207031 573.700012207031 2899.89133817338 2899.89133817338 2899.89133817338 1 0 1 4773 5.61875781183636 -0.809307158494109 0.560223852895276
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7348 M574T3698 573.700012207031 573.700012207031 573.700012207031 3698.49078265362 3698.49078265362 3698.49078265362 1 1 0 4194 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7349 M574T3301 573.799987792969 573.799987792969 573.799987792969 3300.52179370591 3300.52179370591 3300.52179370591 1 1 0 167 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7350 M574T2924 573.799987792969 573.799987792969 573.799987792969 2923.6821033927 2923.6821033927 2923.6821033927 1 1 0 2861 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7351 M574T2755 573.799987792969 573.799987792969 573.799987792969 2754.64826033204 2754.64826033204 2754.64826033204 1 0 1 4610 Inf 1.08652902587589 0.473614293483888
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7352 M574T3704 574 574 574 3704.4561249182 3701.23529883703 3707.67695099937 2 1 1 17 1.45282588576843 -0.681913404759561 0.611474418909005
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7353 M574T3013 574 574 574 3012.85258060488 3012.85258060488 3012.85258060488 1 1 0 2090 3.80950453009244 -0.713331319298512 0.59348166050099
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7354 M574T3262 574 574 574 3262.34420918678 3262.34420918678 3262.34420918678 1 1 0 79 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7355 M574T3311 574 574 574 3310.74369515843 3310.74369515843 3310.74369515843 1 0 1 [M-H]- 575.011 4 2.73684934880462 0.996598923354483 0.450491236194341
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7356 M574T4080 574.100036621094 574.100036621094 574.100036621094 4079.84755767105 4079.84755767105 4079.84755767105 1 1 0 5737 Inf -1.23106373756292 0.434301666202737
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7357 M574T3629 574.100036621094 574.100036621094 574.100036621094 3629.14687270421 3629.14687270421 3629.14687270421 1 0 1 1625 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7358 M574T3414 574.100036621094 574.100036621094 574.100036621094 3414.30751736389 3414.30751736389 3414.30751736389 1 1 0 891 1.74314026972932 -2.0508206019586 0.286550975244509
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7359 M574T4016 574.100036621094 574.100036621094 574.100036621094 4016.3492449455 4016.3492449455 4016.3492449455 1 1 0 5973 Inf -1.12133728607365 0.463625944741982
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7360 M574T3593 574.100036621094 574.100036621094 574.100036621094 3593.21101663136 3593.21101663136 3593.21101663136 1 0 1 5888 1.03196082900786 0.0222414955030973 0.984276601334661
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7361 M574T4215 574.100036621094 574.100036621094 574.100036621094 4214.82417598892 4214.82417598892 4214.82417598892 1 1 0 5337 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7362 M574T4036 574.299987792969 574.299987792969 574.299987792969 4035.63554601029 4033.78549900285 4037.48559301773 2 2 0 92 13.3785181723525 -1.62705154254765 0.350735350158129
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7363 M574T2725 574.299987792969 574.299987792969 574.299987792969 2724.82204503719 2724.82204503719 2724.82204503719 1 1 0 2534 16.9486979674088 -1.47933407322249 0.375458884721835
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7364 M574T3054 574.299987792969 574.299987792969 574.299987792969 3053.68274380949 3053.68274380949 3053.68274380949 1 0 1 81 Inf 3.90942483121305 0.159423966714469
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7365 M574T3614 574.299987792969 574.299987792969 574.299987792969 3613.64356598996 3613.64356598996 3613.64356598996 1 1 0 [159][M+1]- 51 4.13734115176578 -0.84678340712228 0.550663844771673
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7366 M574T3167 574.299987792969 574.299987792969 574.299987792969 3167.07809896551 3167.07809896551 3167.07809896551 1 0 1 746 3.51964763588621 -0.713052756098421 0.604138955807984
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7367 M574T4211 574.299987792969 574.299987792969 574.299987792969 4211.42241894895 4211.42241894895 4211.42241894895 1 1 0 4944 5.76495925156936 -0.81437714667959 0.558557974763568
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7368 M574T3296 574.400024414062 574.400024414062 574.400024414062 3295.98911433759 3295.98911433759 3295.98911433759 1 0 1 2609 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7369 M574T2677 574.400024414062 574.400024414062 574.400024414062 2677.32720048426 2677.32720048426 2677.32720048426 1 1 0 6 2.18430433251837 -0.604809661180638 0.618715301701534
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7370 M574T3356 574.400024414062 574.400024414062 574.400024414062 3356.22399522586 3356.22399522586 3356.22399522586 1 0 1 697 6.4687872556056 0.835487387868989 0.551696452980649
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7371 M574T3628 574.400024414062 574.400024414062 574.400024414062 3627.55483492558 3627.55483492558 3627.55483492558 1 0 1 1626 2.69479687014736 0.589626363114626 0.642947467901078
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7372 M574T2530 574.5 574.5 574.5 2529.59328676082 2529.59328676082 2529.59328676082 1 1 0 5605 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7373 M574T4009 574.5 574.5 574.5 4009.23164498528 4009.23164498528 4009.23164498528 1 1 0 5237 4.90193378292794 -0.779935229724253 0.570031919589556
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7374 M574T4163 574.5 574.5 574.5 4162.99467843184 4162.99467843184 4162.99467843184 1 1 0 6116 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7375 M575T2606 574.600036621094 574.600036621094 574.600036621094 2606.129668269 2606.129668269 2606.129668269 1 0 1 4022 8.43944770576956 0.87538498286602 0.53899690267474
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7376 M575T3793 574.600036621094 574.600036621094 574.600036621094 3793.37767615419 3793.37767615419 3793.37767615419 1 1 0 5522 3.39809614506071 -0.677010880357957 0.607126502513894
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7377 M575T2924 574.700012207031 574.700012207031 574.700012207031 2923.6821033927 2923.6821033927 2923.6821033927 1 1 0 2860 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7378 M575T2527 574.700012207031 574.700012207031 574.700012207031 2527.16708488001 2527.16708488001 2527.16708488001 1 0 1 5962 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7379 M575T2739 574.700012207031 574.700012207031 574.700012207031 2738.94046759205 2738.94046759205 2738.94046759205 1 0 1 4442 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7380 M575T2595 574.700012207031 574.700012207031 574.700012207031 2595.02897459635 2595.02897459635 2595.02897459635 1 1 0 61 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7381 M575T2820 574.799987792969 574.799987792969 574.799987792969 2819.9122826629 2819.9122826629 2819.9122826629 1 0 1 3313 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7382 M575T2522 574.900024414062 574.900024414062 574.900024414062 2521.622668269 2521.622668269 2521.622668269 1 0 1 5063 1.48922109649594 0.272726311041421 0.813823550857168
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7383 M575T3189 574.900024414062 574.900024414062 574.900024414062 3189.32784141832 3189.32784141832 3189.32784141832 1 0 1 2209 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7384 M575T3705 575 575 575 3704.60946684459 3704.60946684459 3704.60946684459 1 1 0 1204 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7385 M575T3365 575 575 575 3364.81864344972 3364.81864344972 3364.81864344972 1 1 0 4648 4.14185530171806 -0.925917251830785 0.512972165803963
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7386 M575T2895 575 575 575 2895.05350711479 2895.05350711479 2895.05350711479 1 0 1 95 1.97186603505933 -0.646130891210757 0.585212265016029
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7387 M575T3230 575.100036621094 575.100036621094 575.100036621094 3230.42413323567 3230.42413323567 3230.42413323567 1 1 0 54 2.14512763463331 -0.595701291582482 0.649946786129202
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7388 M575T3843 575.100036621094 575.100036621094 575.100036621094 3842.6100321328 3842.6100321328 3842.6100321328 1 0 1 1425 3.92256305866566 0.72197270145337 0.590330753775039
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7389 M575T2990 575.100036621094 575.100036621094 575.100036621094 2990.0880290423 2990.0880290423 2990.0880290423 1 0 1 4635 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7390 M575T3811 575.200012207031 575.200012207031 575.200012207031 3810.99738439489 3810.99738439489 3810.99738439489 1 1 0 46 2.325062235975 -0.559359022011096 0.669926244745344
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7391 M575T4048 575.299987792969 575.299987792969 575.299987792969 4048.02955084935 4048.02955084935 4048.02955084935 1 1 0 106 1.53898515088881 -0.332468207043632 0.774571195442884
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7392 M575T3101 575.400024414062 575.400024414062 575.400024414062 3100.55606876356 3100.55606876356 3100.55606876356 1 0 1 3154 Inf 1.56293054073945 0.362356404706066
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7395 M575T3040 575.400024414062 575.400024414062 575.400024414062 3039.79965356201 3039.79965356201 3039.79965356201 1 0 1 71 Inf 1.09029256305458 0.472517570076049
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7396 M575T4130 575.400024414062 575.400024414062 575.400024414062 4130.00265569564 4130.00265569564 4130.00265569564 1 0 1 [160][M]- [M+Cl]- 540.425 23 1.61507885666304 0.405093708138087 0.746253871048184
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7397 M576T3277 575.5 575.5 575.5 3277.08420686365 3277.08420686365 3277.08420686365 1 0 1 1218 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7398 M576T2928 575.5 575.5 575.5 2928.01486524893 2928.01486524893 2928.01486524893 1 0 1 3635 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7399 M576T2694 575.5 575.5 575.5 2693.84129290608 2693.84129290608 2693.84129290608 1 0 1 5709 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7400 M576T2729 575.5 575.5 575.5 2729.46044270343 2729.46044270343 2729.46044270343 1 1 0 2535 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7401 M576T3310 575.5 575.5 575.5 3309.99724528819 3309.99724528819 3309.99724528819 1 1 0 562 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7402 M576T3674 575.5 575.5 575.5 3674.31920275314 3674.31920275314 3674.31920275314 1 1 0 3698 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7403 M576T3814 575.5 575.5 575.5 3813.80227691426 3813.80227691426 3813.80227691426 1 1 0 2400 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7404 M576T4034 575.600036621094 575.600036621094 575.600036621094 4033.8000990233 4033.8000990233 4033.8000990233 1 0 1 3786 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7405 M576T3985 575.600036621094 575.600036621094 575.600036621094 3985.32113567117 3985.32113567117 3985.32113567117 1 0 1 4511 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7406 M576T3023 575.700012207031 575.700012207031 575.700012207031 3022.65278644104 3022.65278644104 3022.65278644104 1 0 1 2161 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7407 M576T2977 575.900024414062 575.900024414062 575.900024414062 2976.64003731665 2976.64003731665 2976.64003731665 1 0 1 5289 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7408 M576T2814 575.900024414062 575.900024414062 575.900024414062 2813.62324605292 2813.62324605292 2813.62324605292 1 0 1 3323 6.08626516905608 0.824638804594644 0.555208160798243
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7409 M576T3016 575.900024414062 575.900024414062 575.900024414062 3015.94302783547 3015.94302783547 3015.94302783547 1 1 0 2091 8.01363620066176 -0.868476919354544 0.541175447773355
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7410 M576T2942 576 576 576 2942.34517787606 2942.34517787606 2942.34517787606 1 1 0 2790 Inf -1.57783704369983 0.359618499360046
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7411 M576T3739 576.100036621094 576.100036621094 576.100036621094 3739.40336407542 3739.40336407542 3739.40336407542 1 0 1 4720 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7412 M576T4196 576.100036621094 576.100036621094 576.100036621094 4195.77079269446 4195.77079269446 4195.77079269446 1 1 0 6172 11.7951080401513 -1.76144201022645 0.318906749867908
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7413 M576T2855 576.200012207031 576.200012207031 576.200012207031 2854.71501004499 2846.47495737205 2854.91573801711 5 2 2 [161][M]- 111 2.25885088208481 0.821301449929312 0.526625311735043
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7414 M576T2857 576.299987792969 576.299987792969 576.299987792969 2857.46186375138 2857.46186375138 2857.46186375138 1 1 0 111 6.74121273198382 -2.57196144043193 0.230806582134639
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7415 M576T2758 576.299987792969 576.299987792969 576.299987792969 2758.45713122866 2758.45713122866 2758.45713122866 1 0 1 5494 3.16930388846987 0.652751108256679 0.616627205575355
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7416 M576T4051 576.299987792969 576.299987792969 576.299987792969 4051.19200669252 4051.19200669252 4051.19200669252 1 1 0 [M+Cl+NH3]- 524.306 77 1.2911389746025 0.202068065795215 0.862683390054746
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7417 M576T4336 576.400024414062 576.400024414062 576.400024414062 4336.05557301079 4331.92840158956 4340.18274443202 2 1 1 6220 1.37054263565894 -0.218405507280185 0.849023416868361
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7418 M576T4132 576.400024414062 576.400024414062 576.400024414062 4131.55437805172 4131.55437805172 4131.55437805172 1 0 1 [160][M+1]- 1516 7.54818383351325 0.926215960092686 0.51945688013977
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
7419 M576T3050 576.400024414062 576.400024414062 576.400024414062 3049.85437775332 3049.85437775332 3049.85437775332 1 1 0 3503 5.79131863373923 -0.815263197658073 0.5582675928423
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7420 M576T4042 576.400024414062 576.400024414062 576.400024414062 4041.70103883739 4041.70103883739 4041.70103883739 1 1 0 162 1.23925001724315 0.352250019088693 0.759686757082551
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7421 M576T3714 576.400024414062 576.400024414062 576.400024414062 3714.40967183111 3714.40967183111 3714.40967183111 1 0 1 1161 3.18566519539301 -0.654600214535769 0.615891575130489
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7422 M576T3836 576.400024414062 576.400024414062 576.400024414062 3835.51794589405 3835.51794589405 3835.51794589405 1 0 1 3340 4.83856850607387 0.805765863299789 0.56598117299518
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7423 M576T4304 576.5 576.5 576.5 4303.75940158956 4303.75940158956 4303.75940158956 1 1 0 6225 5.81395348837243 -0.816017446951481 0.558020579379906
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7424 M576T4149 576.5 576.5 576.5 4148.61566113482 4148.61566113482 4148.61566113482 1 0 1 5622 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7425 M576T3706 576.5 576.5 576.5 3706.34494715838 3706.34494715838 3706.34494715838 1 1 0 1205 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7426 M576T4203 576.5 576.5 576.5 4202.93110769693 4202.93110769693 4202.93110769693 1 0 1 5705 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7427 M576T2807 576.5 576.5 576.5 2806.8796637231 2806.8796637231 2806.8796637231 1 1 0 6033 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7428 M576T2935 576.5 576.5 576.5 2934.56017221744 2934.56017221744 2934.56017221744 1 1 0 2796 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7429 M577T3927 576.600036621094 576.600036621094 576.600036621094 3927.41470965586 3927.41470965586 3927.41470965586 1 1 0 3023 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7430 M577T2580 576.799987792969 576.799987792969 576.799987792969 2580.37608488001 2580.37608488001 2580.37608488001 1 0 1 5690 Inf 5.59402985074649 0.112613924217289
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7431 M577T2606 577 577 577 2606.27628676082 2606.27628676082 2606.27628676082 2 1 0 100 6.36154092965048 -0.945513377475566 0.514310568953043
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7432 M577T3700 577 577 577 3700.01873380339 3700.01873380339 3700.01873380339 1 1 0 4200 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7433 M577T3272 577 577 577 3272.25634812786 3272.25634812786 3272.25634812786 1 1 0 5007 8.1558269121153 -0.870866550776437 0.540421038411071
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7434 M577T2837 577 577 577 2836.95437215523 2836.95437215523 2836.95437215523 1 1 0 125 1.33580605538072 0.201244694934619 0.860411867746033
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7435 M577T3731 577 577 577 3731.30552117362 3731.30552117362 3731.30552117362 1 1 0 3588 11.3924921845912 -0.908728814711531 0.528560847589909
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7436 M577T3406 577 577 577 3405.58140371498 3405.58140371498 3405.58140371498 1 0 1 1335 3.58877376163006 0.719698003838424 0.601969017087125
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7437 M577T3695 577.100036621094 577.100036621094 577.100036621094 3694.98442994032 3694.98442994032 3694.98442994032 1 0 1 621 23.5820679086814 1.0542086674532 0.482602160295116
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7438 M577T2855 577.200012207031 577.200012207031 577.200012207031 2855.49925219741 2854.91573801711 2856.08276637771 2 1 1 [161][M+1]- 111 1.39815867220142 0.494063856761377 0.697161687658674
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7439 M577T4149 577.200012207031 577.200012207031 577.200012207031 4148.61566113482 4148.61566113482 4148.61566113482 1 0 1 5623 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7440 M577T3925 577.200012207031 577.200012207031 577.200012207031 3925.3966577881 3925.3966577881 3925.3966577881 1 0 1 3024 2.22750023715628 0.502729578893377 0.683306673945458
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7441 M577T4187 577.200012207031 577.200012207031 577.200012207031 4187.14282299969 4187.14282299969 4187.14282299969 1 0 1 6066 3.93935673826538 0.7232135923242 0.589881148455289
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7442 M577T4124 577.299987792969 577.299987792969 577.299987792969 4123.83434325235 4119.30268860621 4128.36599789849 2 1 1 29 2.94504334966555 -0.653712502501041 0.615374829930293
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7443 M577T3963 577.299987792969 577.299987792969 577.299987792969 3963.47612053684 3963.47612053684 3963.47612053684 1 0 1 36 2.10963566067164 0.492689670062434 0.688427480932205
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7444 M577T2603 577.299987792969 577.299987792969 577.299987792969 2603.000668269 2603.000668269 2603.000668269 1 0 1 5250 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7445 M577T3652 577.400024414062 577.400024414062 577.400024414062 3652.43761267618 3651.9073471602 3652.96787819215 2 1 1 2412 1.44207191048378 -0.251911377060924 0.827149680356258
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7446 M577T3824 577.400024414062 577.400024414062 577.400024414062 3824.47476800986 3824.47476800986 3824.47476800986 2 0 1 [M+Cl]- 542.429 [M-H]- 578.411 33 1.01529556653129 0.0107438741627083 0.992403408459538
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7447 M577T4141 577.400024414062 577.400024414062 577.400024414062 4140.96996477634 4140.96996477634 4140.96996477634 1 1 0 110 1.10445922264332 0.0703401741496824 0.950387262995637
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7448 M577T4129 577.400024414062 577.400024414062 577.400024414062 4128.76175394237 4128.76175394237 4128.76175394237 1 0 1 [160][M+2]- 23 11.1676813967022 0.91655706345261 0.526157044954203
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7449 M577T3469 577.400024414062 577.400024414062 577.400024414062 3468.69467784151 3468.69467784151 3468.69467784151 1 0 1 3108 8.05970826885747 6.28350611235963 0.0475382477653383
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7450 M577T2884 577.400024414062 577.400024414062 577.400024414062 2883.76802139 2883.76802139 2883.76802139 1 1 0 5504 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7451 M577T3971 577.400024414062 577.400024414062 577.400024414062 3971.32398789918 3971.32398789918 3971.32398789918 1 0 1 36 2.30174265202457 0.535399319596378 0.667868687555171
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7452 M577T4175 577.400024414062 577.400024414062 577.400024414062 4175.42447820211 4175.42447820211 4175.42447820211 1 1 0 [162][M]- 115 1.51632381893918 0.536264661367671 0.661603276330735
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7453 M577T3010 577.400024414062 577.400024414062 577.400024414062 3009.90522827653 3009.90522827653 3009.90522827653 1 0 1 2092 Inf 2.20545184211643 0.271006409212553
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7454 M577T3602 577.400024414062 577.400024414062 577.400024414062 3602.42155188414 3602.42155188414 3602.42155188414 1 0 1 1440 1.63652850518133 0.486359012830746 0.710279582712987
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7455 M577T3797 577.400024414062 577.400024414062 577.400024414062 3796.53984724198 3796.53984724198 3796.53984724198 1 1 0 123 2.25630358231839 0.515275652538521 0.677887900305745
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7456 M577T3443 577.400024414062 577.400024414062 577.400024414062 3442.81137684655 3442.81137684655 3442.81137684655 1 1 0 2936 6.8781264159646 -0.845719983516664 0.548409574800413
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7458 M577T2667 577.400024414062 577.400024414062 577.400024414062 2666.99268104941 2666.99268104941 2666.99268104941 1 0 1 4063 5.33396587060086 1.04619742444287 0.470048000756949
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7460 M578T4169 577.5 577.5 577.5 4168.75137888537 4168.75137888537 4168.75137888537 1 0 1 5937 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7462 M578T3335 577.5 577.5 577.5 3335.46357290839 3335.46357290839 3335.46357290839 1 0 1 1125 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7463 M578T4234 577.5 577.5 577.5 4233.65522276304 4233.65522276304 4233.65522276304 1 1 0 6137 1.06846733668335 -0.0467855758421311 0.966952148096458
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7464 M578T3134 577.5 577.5 577.5 3133.69466422371 3133.69466422371 3133.69466422371 1 0 1 5004 Inf 1.59815545025473 0.355945495672489
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7465 M578T2694 577.600036621094 577.600036621094 577.600036621094 2693.9314023906 2693.9314023906 2693.9314023906 1 0 1 5710 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7466 M578T3507 577.600036621094 577.600036621094 577.600036621094 3506.7171790209 3506.7171790209 3506.7171790209 1 0 1 3400 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7467 M578T2950 577.600036621094 577.600036621094 577.600036621094 2949.79655795618 2949.79655795618 2949.79655795618 1 0 1 3206 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7468 M578T2628 577.700012207031 577.700012207031 577.700012207031 2628.18204956049 2628.18204956049 2628.18204956049 1 0 1 2688 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7469 M578T2826 577.799987792969 577.799987792969 577.799987792969 2825.77378996252 2825.77378996252 2825.77378996252 1 1 0 4591 4.97402392511704 -0.783282629534035 0.568899655734083
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7470 M578T2791 577.799987792969 577.799987792969 577.799987792969 2791.02377756377 2791.02377756377 2791.02377756377 1 0 1 929 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7471 M578T3283 577.900024414062 577.900024414062 577.900024414062 3283.39199261657 3283.39199261657 3283.39199261657 1 0 1 1214 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7472 M578T2529 577.900024414062 577.900024414062 577.900024414062 2529.447668269 2529.447668269 2529.447668269 1 0 1 5606 2.64616680707682 -0.581927891237083 0.646324672841149
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7473 M578T2755 577.900024414062 577.900024414062 577.900024414062 2754.64826033204 2754.64826033204 2754.64826033204 1 0 1 4611 2.25859719014044 0.544833052380872 0.676130501323535
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7475 M578T2823 577.900024414062 577.900024414062 577.900024414062 2823.02392446804 2823.02392446804 2823.02392446804 1 0 1 3314 9.98726977412798 1.41289123412448 0.383861170765708
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7476 M578T3397 578 578 578 3396.75139455995 3394.46678522768 3399.03600389222 2 1 1 461 2.453839078527 0.54866437540496 0.661354522439674
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7477 M578T3296 578 578 578 3295.98911433759 3295.98911433759 3295.98911433759 1 0 1 2593 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7478 M578T3525 578 578 578 3525.21568558575 3525.21568558575 3525.21568558575 1 0 1 432 1.49805985435012 -0.276521461274555 0.811416887522393
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7479 M578T2863 578 578 578 2862.7538672413 2862.7538672413 2862.7538672413 1 0 1 3658 5.38288403244635 0.80052922745966 0.563126072838156
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7480 M578T3664 578.100036621094 578.100036621094 578.100036621094 3663.70033557664 3663.70033557664 3663.70033557664 1 0 1 2 4.32078727585411 -1.50279994588062 0.311016525339243
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7481 M578T3753 578.100036621094 578.100036621094 578.100036621094 3753.21170905618 3753.21170905618 3753.21170905618 1 0 1 1031 Inf 4.36961241547461 0.143226067167593
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7484 M578T3879 578.200012207031 578.200012207031 578.200012207031 3879.46035455616 3879.46035455616 3879.46035455616 1 1 0 2756 1.70321166052675 0.356042619099292 0.762781945138659
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7485 M578T3821 578.200012207031 578.200012207031 578.200012207031 3820.57568450422 3820.57568450422 3820.57568450422 1 0 1 1896 2.14684197675025 0.484243223935828 0.692539451205915
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7486 M578T4075 578.200012207031 578.200012207031 578.200012207031 4075.17536970134 4075.17536970134 4075.17536970134 1 0 1 3912 4.00536261715782 0.727988893877967 0.588157522018226
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7488 M578T2852 578.299987792969 578.299987792969 578.299987792969 2852.41195305107 2849.90816808503 2854.91573801711 2 1 1 [M+Cl+NH3]- 526.306 111 2.84152940972 -0.919816314247312 0.474903750128893
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7489 M578T3277 578.299987792969 578.299987792969 578.299987792969 3277.08420686365 3277.08420686365 3277.08420686365 1 0 1 1220 4.65975458744331 1.6351841750148 0.285614030864372
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7493 M578T3600 578.299987792969 578.299987792969 578.299987792969 3599.7189016966 3599.7189016966 3599.7189016966 1 1 0 1435 1.46601643101055 -0.43668054540189 0.705108373903936
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7501 M578T3525 578.5 578.5 578.5 3525.21568558575 3525.21568558575 3525.21568558575 1 0 1 433 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7502 M578T2710 578.5 578.5 578.5 2710.2502608607 2710.2502608607 2710.2502608607 1 0 1 5880 4.83608757571225 0.776788358102038 0.571099977811414
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7503 M579T2700 578.700012207031 578.700012207031 578.700012207031 2700.25221255246 2700.25221255246 2700.25221255246 1 0 1 136 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7504 M579T2614 578.700012207031 578.700012207031 578.700012207031 2614.10128676082 2614.10128676082 2614.10128676082 1 1 0 5805 Inf -1.40462427745664 0.39387069490687
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7506 M579T3173 578.900024414062 578.900024414062 578.900024414062 3173.43617482863 3173.43617482863 3173.43617482863 1 0 1 747 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7507 M579T3239 578.900024414062 578.900024414062 578.900024414062 3239.38536416913 3239.38536416913 3239.38536416913 1 0 1 3473 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7508 M579T2828 578.900024414062 578.900024414062 578.900024414062 2827.71461825419 2827.71461825419 2827.71461825419 1 0 1 121 Inf 4.89373123782508 0.128322216815498
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7511 M579T3335 579 579 579 3335.46595791276 3335.46595791276 3335.46595791276 1 0 1 [M-H]- 580.005 15 Inf 9.62195043754265 0.0659265938021627
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7514 M579T2789 579.100036621094 579.100036621094 579.100036621094 2789.4387683435 2788.46166349723 2792.52216104408 4 2 2 [163][M]- 12 1.0049232386873 0.00872290769361814 0.99387821613696
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7515 M579T4269 579.200012207031 579.200012207031 579.200012207031 4268.86315089905 4268.86315089905 4268.86315089905 1 0 1 6241 Inf 1 0.5
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lecorguille
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7516 M579T2784 579.200012207031 579.200012207031 579.200012207031 2783.54584377994 2783.54584377994 2783.54584377994 1 0 1 930 Inf 1 0.5
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lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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7563 M580T4259 580.5 580.5 580.5 4258.80474443202 4258.80474443202 4258.80474443202 1 0 1 6198 Inf 1 0.5
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lecorguille
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7564 M580T4143 580.5 580.5 580.5 4142.54464326502 4142.54464326502 4142.54464326502 1 1 0 4248 Inf -1 0.5
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7572 M581T3261 581 581 581 3261.18345621756 3261.18345621756 3261.18345621756 1 1 0 3613 Inf -1 0.5
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7707 M585T2531 584.900024414062 584.900024414062 584.900024414062 2531.012668269 2531.012668269 2531.012668269 1 0 1 5607 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7711 M585T3485 585 585 585 3485.46413109407 3485.46413109407 3485.46413109407 1 1 0 1815 12.7972621738698 -2.62042532068 0.212801175353686
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lecorguille
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lecorguille
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diff changeset
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lecorguille
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7714 M585T4110 585.100036621094 585.100036621094 585.100036621094 4109.63932175949 4109.63932175949 4109.63932175949 1 1 0 2318 1.53521011434597 -0.292117143040046 0.801604621924406
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lecorguille
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7715 M585T3955 585.100036621094 585.100036621094 585.100036621094 3955.35967654843 3955.35967654843 3955.35967654843 1 0 1 5465 1.11440156699612 0.0764055208640761 0.946123420367929
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7716 M585T3711 585.100036621094 585.100036621094 585.100036621094 3710.74931945113 3710.74931945113 3710.74931945113 1 1 0 1207 Inf -7.46475833410932 0.0847786311133769
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lecorguille
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7717 M585T3597 585.100036621094 585.100036621094 585.100036621094 3596.57532421235 3596.57532421235 3596.57532421235 1 0 1 1462 4.93845784781314 1.8831571537592 0.236252859918577
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7718 M585T3700 585.200012207031 585.200012207031 585.200012207031 3699.67108063199 3699.67108063199 3699.67108063199 1 0 1 4197 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7719 M585T3940 585.200012207031 585.200012207031 585.200012207031 3939.58919937721 3939.58919937721 3939.58919937721 1 0 1 4127 1.33810095478369 1.00902948918797 0.494847357884372
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7722 M585T3925 585.299987792969 585.299987792969 585.299987792969 3925.3966577881 3925.3966577881 3925.3966577881 1 0 1 2963 1.00713859357348 -0.00822167782088816 0.994188755093566
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7725 M585T3692 585.400024414062 585.400024414062 585.400024414062 3691.86366065346 3691.86366065346 3691.86366065346 1 0 1 622 Inf 1.18659987108116 0.445803505348348
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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7729 M585T2674 585.400024414062 585.400024414062 585.400024414062 2674.38567396616 2674.38567396616 2674.38567396616 1 0 1 682 Inf 1 0.5
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lecorguille
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7730 M585T3218 585.400024414062 585.400024414062 585.400024414062 3217.73869301511 3217.73869301511 3217.73869301511 1 1 0 4337 Inf -1 0.5
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lecorguille
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lecorguille
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7732 M585T3792 585.400024414062 585.400024414062 585.400024414062 3791.80656568733 3791.80656568733 3791.80656568733 1 1 0 5768 1.99582759799024 0.488031818479893 0.705473290318148
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7735 M586T3912 585.5 585.5 585.5 3911.55024985287 3911.55024985287 3911.55024985287 1 1 0 4854 2.20314274798124 -0.543965937144415 0.681704294834037
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7736 M586T3439 585.5 585.5 585.5 3438.75373296649 3438.75373296649 3438.75373296649 1 0 1 2938 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7737 M586T4023 585.5 585.5 585.5 4023.16200530608 4023.16200530608 4023.16200530608 1 0 1 5585 Inf 1 0.5
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lecorguille
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7738 M586T2990 585.600036621094 585.600036621094 585.600036621094 2990.0880290423 2990.0880290423 2990.0880290423 1 0 1 4622 Inf 1 0.5
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lecorguille
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7739 M586T3329 585.799987792969 585.799987792969 585.799987792969 3329.2716485188 3329.2716485188 3329.2716485188 1 0 1 1128 2.31028895026888 0.520487517338159 0.674653512736197
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7740 M586T4029 585.900024414062 585.900024414062 585.900024414062 4029.13245804437 4029.13245804437 4029.13245804437 1 0 1 3787 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7741 M586T2985 585.900024414062 585.900024414062 585.900024414062 2984.51802575295 2984.51802575295 2984.51802575295 1 1 0 4623 3.53585484706753 -0.791538642268288 0.5737446201851
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7742 M586T3339 585.900024414062 585.900024414062 585.900024414062 3338.56144684373 3338.56144684373 3338.56144684373 1 0 1 1129 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7743 M586T2762 585.900024414062 585.900024414062 585.900024414062 2761.59491820405 2761.59491820405 2761.59491820405 1 1 0 94 2.63486772721752 -1.61903991128372 0.345348676866642
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7745 M586T3349 586 586 586 3348.80366272404 3346.17024337331 3351.43708207476 2 1 1 694 1.6404572033801 0.737279357709943 0.53909907399242
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7748 M586T3558 586 586 586 3557.96039237637 3557.96039237637 3557.96039237637 1 0 1 1684 Inf 1 0.5
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lecorguille
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7749 M586T4144 586.100036621094 586.100036621094 586.100036621094 4144.10937409083 4144.10937409083 4144.10937409083 1 1 0 5837 Inf -1 0.5
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lecorguille
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7750 M586T3730 586.100036621094 586.100036621094 586.100036621094 3730.04049187645 3730.04049187645 3730.04049187645 1 0 1 3541 1.35935928571765 0.212946119979341 0.852633509881449
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7751 M586T4127 586.200012207031 586.200012207031 586.200012207031 4126.79074467143 4126.79074467143 4126.79074467143 1 1 0 1465 3.57578156866405 -1.7351968498911 0.225906604817407
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7752 M586T3221 586.299987792969 586.299987792969 586.299987792969 3220.78239565264 3220.78239565264 3220.78239565264 1 1 0 4338 1.55105236532894 -0.368909088745586 0.74792391974502
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7753 M586T4209 586.299987792969 586.299987792969 586.299987792969 4209.24519464898 4209.24519464898 4209.24519464898 1 0 1 4947 Inf 1.74286267554992 0.331620593743873
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7754 M586T2829 586.400024414062 586.400024414062 586.400024414062 2828.97287981685 2828.97287981685 2828.97287981685 1 1 0 4592 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7755 M586T2752 586.400024414062 586.400024414062 586.400024414062 2751.57037716105 2751.57037716105 2751.57037716105 1 0 1 114 3.65067615549125 0.700281134766686 0.598307975286847
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7756 M586T3790 586.400024414062 586.400024414062 586.400024414062 3789.65430237007 3789.65430237007 3789.65430237007 1 0 1 4464 10.8170877328515 0.986265675661288 0.50177126986123
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lecorguille
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7757 M586T3808 586.400024414062 586.400024414062 586.400024414062 3807.51847288027 3807.51847288027 3807.51847288027 1 1 0 3721 14.6369333428867 -0.929512875459445 0.522092787957519
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7758 M586T4142 586.400024414062 586.400024414062 586.400024414062 4142.41184997807 4142.41184997807 4142.41184997807 1 0 1 4250 1.32755733764234 -0.327501365828038 0.798485755398775
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7759 M586T3726 586.400024414062 586.400024414062 586.400024414062 3726.1786920407 3726.1786920407 3726.1786920407 1 1 0 4687 Inf -1 0.5
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lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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lecorguille
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7788 M587T2614 587.400024414062 587.400024414062 587.400024414062 2613.954668269 2613.954668269 2613.954668269 1 0 1 5806 2.24460431654673 -0.506495755700029 0.681453829734532
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7791 M588T3261 587.5 587.5 587.5 3260.74570744212 3260.74570744212 3260.74570744212 1 1 0 3611 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7792 M588T4242 587.5 587.5 587.5 4242.25815089905 4242.25815089905 4242.25815089905 1 0 1 6104 Inf 2.20765491164458 0.270767433740204
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7793 M588T3706 587.5 587.5 587.5 3706.34494715838 3706.34494715838 3706.34494715838 1 1 0 17 22.4546668410039 -0.954519750716562 0.514307574401041
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7796 M588T3849 587.600036621094 587.600036621094 587.600036621094 3848.91096638375 3848.91096638375 3848.91096638375 1 0 1 1430 Inf 1 0.5
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lecorguille
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7797 M588T2590 587.700012207031 587.700012207031 587.700012207031 2590.480668269 2590.480668269 2590.480668269 1 0 1 2914 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7799 M588T3152 588.100036621094 588.100036621094 588.100036621094 3151.86591620274 3151.86591620274 3151.86591620274 1 0 1 3050 1.5341035766742 0.419751153924201 0.741364131948708
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7804 M588T2792 588.200012207031 588.200012207031 588.200012207031 2791.5834804339 2791.5834804339 2791.5834804339 2 0 1 [169][M]- 12 3.04997874518266 0.979329294815328 0.505800457082751
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7807 M588T3219 588.299987792969 588.299987792969 588.299987792969 3219.26019246365 3216.21383884379 3222.30654608352 2 2 0 [M+Cl+HCOOH]- 507.329 [M-H+HCOOH]- 543.306 113 3.3801562672335 -1.63765277293961 0.347472274274341
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7808 M588T2881 588.299987792969 588.299987792969 588.299987792969 2881.24660857796 2881.24660857796 2881.24660857796 1 0 1 4752 1.6924515689223 0.444163525491219 0.701556313031479
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7812 M588T3406 588.400024414062 588.400024414062 588.400024414062 3406.49606836566 3406.49606836566 3406.49606836566 1 1 0 1338 Inf -1 0.5
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lecorguille
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7813 M588T3900 588.5 588.5 588.5 3900.45734732015 3900.45734732015 3900.45734732015 1 1 0 4856 Inf -1 0.5
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lecorguille
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7814 M588T4288 588.5 588.5 588.5 4287.64215089905 4287.64215089905 4287.64215089905 1 0 1 6097 1.83891560516736 0.400775702103598 0.737064370431964
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7815 M588T4152 588.5 588.5 588.5 4151.9407210797 4151.9407210797 4151.9407210797 1 1 0 6051 10.1028224795676 -0.896636077399078 0.532333536393623
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7816 M588T2863 588.5 588.5 588.5 2862.7538672413 2862.7538672413 2862.7538672413 1 0 1 3638 4.15801223296611 1.44203478822316 0.385230077317915
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7817 M588T3201 588.5 588.5 588.5 3200.50582922137 3200.50582922137 3200.50582922137 1 1 0 1764 Inf -1 0.5
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7818 M589T2744 588.600036621094 588.600036621094 588.600036621094 2744.27300671808 2744.27300671808 2744.27300671808 1 1 0 4594 3.94867190078192 -1.25654008664085 0.376719165287263
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7820 M589T2708 588.799987792969 588.799987792969 588.799987792969 2707.83509055926 2707.83509055926 2707.83509055926 1 1 0 5881 Inf -1 0.5
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7828 M589T3399 589 589 589 3399.23270608822 3399.23270608822 3399.23270608822 1 0 1 1302 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7845 M590T4058 589.5 589.5 589.5 4057.84069288953 4057.84069288953 4057.84069288953 1 0 1 129 1.26292989653619 0.16321947073674 0.886041082081527
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7847 M590T2543 589.5 589.5 589.5 2543.38497459635 2543.38497459635 2543.38497459635 1 1 0 5171 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7852 M590T2575 589.700012207031 589.700012207031 589.700012207031 2574.97728676082 2574.97728676082 2574.97728676082 1 1 0 4084 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7854 M590T2583 589.799987792969 589.799987792969 589.799987792969 2582.655668269 2582.655668269 2582.655668269 1 0 1 5693 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7864 M590T3811 590.100036621094 590.100036621094 590.100036621094 3810.99738439489 3810.99738439489 3810.99738439489 1 1 0 46 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7868 M590T3199 590.200012207031 590.200012207031 590.200012207031 3198.69652756328 3198.69652756328 3198.69652756328 1 0 1 [M-H]- 591.206 30 1.29442983116118 -0.26257119777318 0.835826140739499
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7873 M590T2996 590.299987792969 590.299987792969 590.299987792969 2995.83048403819 2995.65476081924 3001.73340037252 3 2 1 [170][M]- 32 2.44756530121956 0.615559334439446 0.63934781296597
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7875 M590T4428 590.299987792969 590.299987792969 590.299987792969 4427.81974443202 4427.81974443202 4427.81974443202 1 0 1 6189 1.26161369193161 0.162506483879413 0.886526375694309
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7878 M590T4439 590.400024414062 590.400024414062 590.400024414062 4438.77474443202 4438.77474443202 4438.77474443202 1 0 1 6222 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7879 M590T4407 590.400024414062 590.400024414062 590.400024414062 4407.47574443202 4407.47574443202 4407.47574443202 1 0 1 303 2.02800616546917 0.853280267281131 0.48444853656625
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7880 M590T2908 590.5 590.5 590.5 2907.85570574063 2907.85570574063 2907.85570574063 1 0 1 2789 28.0170749107674 1.24472693120996 0.430204867649522
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7881 M590T3931 590.5 590.5 590.5 3930.58943685684 3930.58943685684 3930.58943685684 1 1 0 3028 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7897 M591T3450 591.299987792969 591.299987792969 591.299987792969 3449.98429869677 3449.98429869677 3449.98429869677 1 0 1 3339 3.75744317963291 5.32774587709554 0.0945122334326736
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
7898 M591T2730 591.299987792969 591.299987792969 591.299987792969 2729.94511150645 2729.94511150645 2729.94511150645 1 0 1 2458 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7899 M591T3689 591.400024414062 591.400024414062 591.400024414062 3689.38090470945 3686.31999191776 3692.44181750114 2 1 1 568 2.36397079436246 -0.680115967427141 0.581508717968277
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7902 M591T2931 591.400024414062 591.400024414062 591.400024414062 2931.49215953279 2931.49215953279 2931.49215953279 1 0 1 3637 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7903 M591T2842 591.400024414062 591.400024414062 591.400024414062 2841.92334379822 2841.92334379822 2841.92334379822 1 0 1 6054 6.43610621017207 1.31837000348476 0.394579299225502
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
7904 M591T3566 591.400024414062 591.400024414062 591.400024414062 3566.14316934182 3566.14316934182 3566.14316934182 1 1 0 1687 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
7905 M591T3582 591.400024414062 591.400024414062 591.400024414062 3581.86342323267 3581.86342323267 3581.86342323267 1 0 1 1688 1.7146006754636 0.360017222316706 0.760446757831175
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
7907 M592T3654 591.5 591.5 591.5 3654.3034227609 3654.3034227609 3654.3034227609 1 0 1 2414 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
diff changeset
7908 M592T4176 591.5 591.5 591.5 4175.56395558154 4175.56395558154 4175.56395558154 1 1 0 115 1.54993302651819 -0.342541525382017 0.784118122135333
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
7910 M592T3351 591.600036621094 591.600036621094 591.600036621094 3350.85695421667 3350.85695421667 3350.85695421667 1 1 0 688 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
7912 M592T2574 591.900024414062 591.900024414062 591.900024414062 2574.11608488001 2574.11608488001 2574.11608488001 1 0 1 104 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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diff changeset
7913 M592T3097 592 592 592 3096.58069253063 3096.58069253063 3096.58069253063 1 0 1 5377 2.34048104991554 0.526678006868653 0.671686528100774
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7914 M592T2580 592 592 592 2580.37608488001 2580.37608488001 2580.37608488001 1 0 1 5694 Inf 2.90985915492952 0.210730636698538
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
parents:
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7915 M592T3155 592 592 592 3154.99597263236 3154.99597263236 3154.99597263236 1 0 1 5905 1.1254386258976 0.104534531519389 0.93079567776362
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7916 M592T3427 592 592 592 3427.45273613588 3427.45273613588 3427.45273613588 1 1 0 5276 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7920 M592T3052 592.100036621094 592.100036621094 592.100036621094 3051.82258433502 3047.63518465713 3056.0099840129 2 1 1 [M-2H+Na]- 571.112 [M-H]- 593.105 81 1.15116393401428 0.109200642954955 0.923779725763125
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7921 M592T3677 592.100036621094 592.100036621094 592.100036621094 3676.65147378151 3676.65147378151 3676.65147378151 1 1 0 3699 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7925 M592T3792 592.200012207031 592.200012207031 592.200012207031 3791.80656568733 3791.80656568733 3791.80656568733 1 1 0 5769 Inf -2.55129067041488 0.23781241207703
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7927 M592T3127 592.299987792969 592.299987792969 592.299987792969 3127.02558628348 3127.02558628348 3127.02558628348 1 1 0 5593 Inf -1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7928 M592T2997 592.299987792969 592.299987792969 592.299987792969 2997.23949272726 2997.23949272726 2997.23949272726 1 0 1 [170][M+2]- 32 2.08476797211616 0.556872085441166 0.657562236016362
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7930 M592T4280 592.400024414062 592.400024414062 592.400024414062 4279.81715089905 4279.81715089905 4279.81715089905 1 0 1 266 Inf 1.71555555555571 0.335977505538464
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lecorguille
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7931 M592T4132 592.400024414062 592.400024414062 592.400024414062 4131.55437805172 4131.55437805172 4131.55437805172 1 0 1 [171][M+1]- 23 1.03705668434311 0.0359617753003798 0.975213631475486
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7932 M592T2960 592.400024414062 592.400024414062 592.400024414062 2959.50397850139 2959.50397850139 2959.50397850139 1 1 0 3286 Inf -1 0.5
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lecorguille
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7933 M592T3408 592.400024414062 592.400024414062 592.400024414062 3407.93011205244 3407.93011205244 3407.93011205244 1 0 1 2556 Inf 1 0.5
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lecorguille
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7934 M592T3309 592.5 592.5 592.5 3308.58072998214 3308.58072998214 3308.58072998214 1 0 1 565 16.6632005977361 0.938299396522778 0.519359668408012
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7935 M592T2720 592.5 592.5 592.5 2720.07390364244 2720.07390364244 2720.07390364244 1 0 1 2538 Inf 4.03689791297675 0.154588394642758
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lecorguille
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7936 M592T2745 592.5 592.5 592.5 2744.96875868878 2744.96875868878 2744.96875868878 1 1 0 4613 Inf -1 0.5
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lecorguille
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7937 M592T3920 592.5 592.5 592.5 3919.5716518483 3919.5716518483 3919.5716518483 1 0 1 2953 Inf 1 0.5
7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7938 M592T3490 592.5 592.5 592.5 3490.33071116467 3490.33071116467 3490.33071116467 1 0 1 1816 1.04198713717888 -0.0323684967662014 0.977335332919584
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lecorguille
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7939 M592T2785 592.5 592.5 592.5 2785.03277491933 2785.03277491933 2785.03277491933 1 0 1 933 Inf 1 0.5
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lecorguille
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7940 M593T2894 592.700012207031 592.700012207031 592.700012207031 2893.79600239851 2893.79600239851 2893.79600239851 1 0 1 3821 4.27078214755524 0.759932656995743 0.583158881786106
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7941 M593T2821 592.700012207031 592.700012207031 592.700012207031 2821.46649827494 2821.46649827494 2821.46649827494 1 0 1 3316 Inf 1 0.5
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lecorguille
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7942 M593T3502 592.700012207031 592.700012207031 592.700012207031 3502.4895121465 3502.4895121465 3502.4895121465 1 1 0 3402 Inf -1 0.5
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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7da9252dd983 planemo upload commit 9d47e3b467dbbe0af0d90a937c5e9f2c4b958c4b
lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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lecorguille
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8144 M600T3605 599.5 599.5 599.5 3604.78487735047 3604.78487735047 3604.78487735047 1 0 1 1463 Inf 1 0.5
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8145 M600T3410 599.5 599.5 599.5 3409.6137638498 3409.6137638498 3409.6137638498 1 1 0 2557 Inf -1 0.5
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8146 M600T3002 599.5 599.5 599.5 3001.73340037252 3001.73340037252 3001.73340037252 1 1 0 4097 Inf -1 0.5
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