--- /dev/null	Thu Jan 01 00:00:00 1970 +0000
+++ b/test-data/test1_fill_xcms_1.msp	Tue Mar 22 16:09:16 2022 +0000
@@ -0,0 +1,1991 @@
+NAME:C001
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:38.74
+Num Peaks:57
+216.9205 32607700
+256.8215 31377637
+175.0641 26780143
+206.9034 26130980
+254.8252 23747536
+198.8647 21688594
+196.8658 21390430
+372.7383 19374863
+258.8237 15532799
+382.8218 12815572
+488.6825 12267966
+392.7685 10913351
+316.7777 10734168
+440.7322 10603010
+138.9121 10186226
+312.7841 10051801
+434.7287 9943329
+266.8652 9805546
+370.7418 9765463
+450.7016 8762673
+324.9549 8619910
+428.7834 8554675
+384.8177 8311500
+442.7401 8271752
+200.8848 7742528
+492.744 7662344
+494.8953 7188793
+546.6093 7177067
+498.8794 6811405
+500.8484 6520691
+322.8157 6317648
+350.9875 6150799
+550.6949 6104789
+426.7772 5431633
+566.5977 5171811
+510.763 4989757
+486.7743 4886062
+460.7076 4528973
+484.7242 4273989
+518.7415 4243468
+334.849 4178412
+413.2664 3965867
+436.8161 3705247
+502.7832 3567833
+342.8093 3285552
+366.8281 3253770
+306.9914 3169316
+268.8537 3090354
+800.4451 2792137
+186.1095 2675456
+234.0134 2550129
+462.7862 2123666
+349.9455 2050695
+612.6927 2005587
+676.6436 1982714
+351.941 1965882
+148.9337 1008656
+
+NAME:C002
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:520.25
+Num Peaks:35
+525.375 1073323842
+310.1623 295359836
+526.3783 181668883
+1047.7378 150394804
+551.3321 111616808
+1048.7399 90978863
+289.6491 46498377
+312.0296 38757284
+1075.1968 33352763
+1049.7432 29946438
+552.3348 28340614
+813.5403 25060147
+527.3812 23642795
+309.1649 18045974
+301.1565 15185412
+311.1658 13124727
+330.6757 12666597
+624.296 11790213
+1076.2004 10417953
+578.2905 7578406
+562.3269 7538206
+1050.7453 6807767
+267.2688 6103973
+814.5336 5865975
+1069.7158 5074652
+619.3008 4742103
+1216.8041 4439324
+1206.3127 3738816
+1217.807 3565334
+1074.1979 3402288
+553.3314 2609936
+955.1171 2322927
+1101.6535 2023916
+131.1733 1971789
+279.0196 1946255
+
+NAME:C003
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:483.67
+Num Peaks:26
+522.3565 4089569222
+523.354 1201714423
+288.6414 202172046
+1043.7028 144351468
+1044.7068 83271854
+549.3267 63300808
+279.6362 29849749
+1045.706 27998321
+1058.1594 20718345
+1071.1639 15461047
+378.2093 15309961
+796.9808 13576738
+809.9883 12596682
+265.2529 11366224
+280.6546 8848921
+576.2749 7386007
+1059.1626 6608764
+810.9916 6601055
+1046.7131 6505178
+797.9841 6368973
+1072.1671 5096642
+625.4543 4040374
+379.1966 2902366
+577.3074 2354251
+617.2778 2323470
+266.2564 1420444
+
+NAME:C004
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:473.48
+Num Peaks:24
+496.34 12577588056
+497.3442 3337125302
+991.6726 1420557258
+992.6749 763118028
+498.3462 532285213
+993.6787 239161906
+296.147 190395687
+1017.6897 168186952
+482.3247 145772322
+1018.6656 120599518
+499.3493 68176083
+1019.6555 57647644
+994.6801 53549573
+770.964 49250157
+483.3283 36245876
+275.6336 28001849
+771.9675 22666873
+1020.6591 12469103
+783.9721 9839299
+949.6233 8009033
+124.1405 6517662
+950.6274 3674694
+784.9749 3622908
+170.2437 1237313
+
+NAME:C005
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:41.72
+Num Peaks:20
+337.0623 88672453
+359.0443 48435582
+353.0361 37061354
+375.018 29159485
+218.1386 14009249
+417.0027 13822994
+381.0261 13522755
+438.9851 11307111
+396.9999 10317665
+454.9592 9820452
+432.9764 9779399
+338.0654 8770055
+360.0459 5025128
+418.9966 4386311
+512.8989 4072570
+456.9603 3774845
+470.9263 3632486
+572.871 3485486
+440.9796 3364168
+376.0216 2740193
+
+NAME:C006
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:452.08
+Num Peaks:19
+494.3249 803829845
+495.3278 207959661
+542.3239 193323900
+543.3276 55501736
+1087.6715 34676828
+516.3076 24092471
+274.6257 21694276
+1088.6773 21466528
+1001.658 11852076
+1089.682 9948820
+290.6256 9704443
+1061.6562 9417442
+987.6411 7453650
+1037.6578 7076912
+1062.6592 5657208
+484.3311 5283943
+265.6196 4371245
+988.6455 3739523
+471.1945 2160605
+
+NAME:C007
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:568.2
+Num Peaks:15
+358.2442 106872298
+234.1324 59050456
+188.0007 52041531
+239.2372 26344305
+477.2519 11827163
+585.9028 8902947
+357.238 7379522
+426.2308 5286033
+240.2407 4459744
+233.1437 3922399
+222.6244 3385929
+186.0063 3083451
+221.2257 2567396
+189.0039 2523814
+229.0269 867587
+
+NAME:C008
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:429.17
+Num Peaks:15
+286.1443 678064374
+287.1479 122889402
+376.2598 104678013
+393.2867 29696724
+398.2416 23513763
+377.263 22500000
+308.126 22425844
+593.2789 15955209
+201.0585 12214676
+475.3648 10668083
+115.0544 5827739
+309.1297 4382098
+256.26 2558551
+236.1231 1734151
+444.2974 1144591
+
+NAME:C009
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:456.73
+Num Peaks:14
+520.3407 5225209356
+521.3439 1495548391
+1039.675 296334239
+1040.6772 169704741
+287.6336 113569471
+278.6264 17428500
+997.6248 14800316
+1021.6269 12502966
+1067.6364 10969869
+806.9648 10540710
+335.1682 10461098
+539.2937 5768815
+807.9689 5556917
+130.1826 3436249
+
+NAME:C010
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:438.79
+Num Peaks:13
+468.3091 298660480
+469.3122 74605200
+492.3091 14962230
+500.2783 12422814
+470.3144 10513291
+490.2906 10495863
+282.1334 7996578
+381.2584 6633225
+298.6263 5761949
+564.3067 4795194
+501.282 3263594
+183.0814 2981313
+491.2968 2431955
+
+NAME:C011
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:465.31
+Num Peaks:13
+546.3555 383799553
+547.3446 131983322
+184.0736 110532874
+1041.6834 90837006
+1042.6858 34768516
+528.3083 30967171
+504.3095 29428619
+1066.6536 18333740
+125 16887384
+300.6409 12001615
+529.3094 8108676
+505.3163 6772098
+782.9657 2439709
+
+NAME:C012
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:39.22
+Num Peaks:11
+96.9225 62967962
+272.7962 13679316
+212.8395 8994833
+404.6892 8814347
+288.779 8191056
+290.7977 4568865
+422.7095 4562755
+170.8763 4123908
+420.6603 3664599
+480.6509 3562470
+154.8822 2030207
+
+NAME:C013
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:39.48
+Num Peaks:11
+203.0531 167631100
+249.0624 25609635
+227.0272 16535154
+264.9601 15156116
+169.0486 13872724
+389.1367 13765849
+226.0764 9468969
+506.6274 6372061
+250.0554 3024291
+122.0613 1727162
+726.5993 1311674
+
+NAME:C014
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:39.33
+Num Peaks:11
+176.0633 15979877
+210.0505 15449502
+390.7218 11447541
+448.6698 9824962
+402.7508 6210443
+332.7687 6016647
+452.7387 5475678
+444.6803 4780956
+564.5853 3917503
+268.0083 1320856
+632.5996 1288164
+
+NAME:C015
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:458.34
+Num Peaks:11
+544.3404 1225750896
+545.3439 374466023
+1063.6731 134466308
+570.3554 115918953
+1064.6791 79612422
+571.3534 37301377
+1065.6812 34277415
+559.3 18421012
+818.9649 6824176
+133.0392 2377532
+592.3319 1860147
+
+NAME:C016
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:38.05
+Num Peaks:10
+225.0469 59892950
+152.0216 58787867
+200.0631 54989442
+125.9853 20256452
+154.0796 17471055
+117.0558 8912239
+123.0133 6506577
+214.0165 5828884
+128.0168 3493680
+262.1042 1191413
+
+NAME:C017
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:39.26
+Num Peaks:10
+135.0046 68491054
+308.8763 7782902
+310.8765 7492963
+261.0198 6541108
+326.8343 5180455
+251.1353 4829854
+320.9624 4504376
+236.9895 3334317
+192.9904 3145024
+262.9367 1798075
+
+NAME:C018
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:454.48
+Num Peaks:10
+478.2937 332073307
+502.294 203097896
+479.2975 82619606
+503.2971 56245739
+1079.1344 12647964
+396.3107 5070738
+1080.1364 4163189
+460.2793 3911971
+819.9685 3407741
+979.5825 2776558
+
+NAME:C019
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:42.78
+Num Peaks:9
+114.9111 32990841
+389.9726 11145004
+164.9322 7431207
+405.9475 5844544
+447.9245 2426472
+216.0284 1605907
+365.9668 1446420
+505.8763 1329836
+507.8783 648316
+
+NAME:C020
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:54.99
+Num Peaks:9
+293.0983 2422772404
+294.1014 257775459
+198.0937 131560403
+347.0176 47407058
+174.0125 36962385
+295.102 32422311
+638.0996 10689139
+348.021 4803964
+661.0894 2312323
+
+NAME:C021
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:38.53
+Num Peaks:9
+156.0426 222394961
+219.0263 57128369
+158.0428 18805186
+214.8414 9188386
+243.0514 5726028
+221.0125 4427671
+476.8048 4253268
+300.917 1014846
+266.0228 865794
+
+NAME:C022
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:39.11
+Num Peaks:9
+270.8003 10913935
+446.6714 9101385
+328.7861 5462630
+466.7313 4933554
+514.696 3743953
+582.6038 3668915
+640.5143 1982245
+830.3697 1650429
+816.3996 1639206
+
+NAME:C023
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:41.74
+Num Peaks:9
+188.0708 86813172
+205.0972 60709701
+232.9318 25933446
+146.0645 18564145
+170.0751 7231551
+286.9372 7044982
+206.1002 7041628
+253.1035 6018088
+355.0172 4540271
+
+NAME:C024
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:556.73
+Num Peaks:9
+269.2251 98997424
+270.2293 21011406
+95.0857 4595720
+286.2294 4043920
+255.2054 2246657
+271.2328 1949807
+213.1634 1358632
+201.1645 1071554
+199.1466 1069553
+
+NAME:C025
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:480.14
+Num Peaks:9
+480.3242 225142434
+481.3283 57405909
+572.372 31453561
+573.3745 10605576
+975.643 9623856
+339.2894 7507144
+530.3239 6943908
+976.6459 4287929
+462.2982 1796039
+
+NAME:C026
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:426.54
+Num Peaks:9
+209.1227 23179929
+368.2797 23024870
+344.2799 20088935
+251.08 18575424
+369.2898 5324942
+345.2809 4025576
+388.2683 3724460
+252.1154 2039708
+447.3136 1897988
+
+NAME:C027
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:416.01
+Num Peaks:9
+512.3351 37021229
+342.2643 34920216
+513.3327 8866978
+366.2639 4336343
+386.2863 4324224
+255.1628 4097834
+121.0995 3144992
+198.1856 2059762
+389.2772 2055946
+
+NAME:C028
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:49
+Num Peaks:8
+160.0625 82372331
+331.0539 60780528
+332.0574 6460288
+629.1524 6206440
+651.1352 4440552
+660.0826 3422585
+381.9922 2334231
+682.0634 1513098
+
+NAME:C029
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:38.86
+Num Peaks:8
+162.1127 308309016
+184.0929 81708077
+163.1147 22045846
+185.0673 10137160
+125.0255 4719310
+496.9328 4556080
+668.7844 2318264
+322.132 1735238
+
+NAME:C030
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:40.08
+Num Peaks:8
+285.099 18100021
+98.0603 11371093
+348.9972 7635486
+161.0222 5114176
+354.0305 3727355
+570.8778 3644920
+164.0967 2446073
+588.8371 1855891
+
+NAME:C031
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:494.99
+Num Peaks:8
+524.3373 4406739555
+510.3567 277170353
+511.3593 74813283
+512.41 43155571
+532.3395 6128954
+543.8175 3281220
+533.3443 1713625
+253.2492 1397116
+
+NAME:C032
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:410.48
+Num Peaks:8
+414.3008 67174004
+432.311 48052180
+450.3216 33099069
+415.3041 18837411
+433.3164 14051812
+451.325 9279876
+504.2415 3861767
+434.3163 2103190
+
+NAME:C033
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:40.16
+Num Peaks:7
+120.0803 58687086
+86.0965 55329962
+180.0807 13815076
+103.0535 11371875
+202.0618 5186609
+121.0765 5168117
+87.0961 3259767
+
+NAME:C034
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:39.56
+Num Peaks:7
+166.0846 178192881
+182.0634 130373801
+116.0619 120691918
+144.0965 108611017
+157.0492 41677273
+167.0832 14989742
+145.0982 8354818
+
+NAME:C035
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:37.63
+Num Peaks:7
+112.9034 85545886
+222.8686 13769163
+238.8437 5325572
+280.8314 5214305
+240.84 3365303
+296.8089 2240176
+298.8014 2106450
+
+NAME:C036
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:37.64
+Num Peaks:7
+408.755 8487354
+398.7404 8038976
+414.7157 5404259
+472.6761 3956681
+474.6969 3506445
+464.7339 2837872
+532.6307 2766988
+
+NAME:C037
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:38.66
+Num Peaks:7
+191.0391 31256068
+318.9532 6922130
+508.7699 6827792
+364.9531 3274488
+124.0559 1972246
+168.0896 1964344
+244.0998 1402698
+
+NAME:C038
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:17.56
+Num Peaks:7
+113.9639 884114874
+141.9589 178232538
+158.9616 128816272
+130.9667 51395622
+117.9597 13415776
+89.94 9040424
+299.9124 1880980
+
+NAME:C039
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:568.17
+Num Peaks:7
+313.2743 49761422
+331.284 25330864
+353.2668 14412912
+314.2779 10250020
+332.288 5165351
+109.0936 3367194
+378.7574 2750830
+
+NAME:C040
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:387.74
+Num Peaks:7
+181.0835 84943549
+223.1099 46655050
+448.3062 12015194
+211.1705 9133246
+224.1132 5667427
+163.086 4875483
+626.3529 4834637
+
+NAME:C041
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:453.17
+Num Peaks:7
+568.34 320070712
+526.294 130284635
+569.3431 103890431
+527.2969 38181651
+590.322 5188496
+493.3513 4170416
+538.2924 3722053
+
+NAME:C042
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:494.9
+Num Peaks:7
+548.3718 57710648
+506.3605 33858286
+464.314 19745728
+281.652 16902444
+507.3635 10018492
+421.2329 9340554
+465.3171 4874193
+
+NAME:C043
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:496.93
+Num Peaks:7
+149.0237 1046269875
+121.0291 104312995
+303.1553 88839098
+327.2198 14111373
+91.0544 7737151
+583.4371 5272741
+371.2241 2045984
+
+NAME:C044
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:439.39
+Num Peaks:7
+415.212 83379727
+437.1949 23384573
+416.2152 22144229
+514.3191 7670834
+453.1967 6996965
+438.1974 6181203
+432.2384 4602293
+
+NAME:C045
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:38.72
+Num Peaks:6
+204.1232 104594587
+424.7473 5143002
+220.0361 3822478
+482.7147 3819577
+526.6926 3098115
+85.0374 922414
+
+NAME:C046
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:522.9
+Num Peaks:6
+680.4293 23371624
+1204.2998 12180905
+681.433 10790523
+942.6132 7409370
+693.4366 6450701
+694.4422 2967375
+
+NAME:C047
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:568.96
+Num Peaks:6
+523.885 65066801
+688.5201 14341797
+524.8874 7166738
+689.5235 6478555
+522.8873 4794972
+715.4799 3672190
+
+NAME:C048
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:570.42
+Num Peaks:6
+596.8946 15091259
+597.9015 7000919
+762.0311 5271486
+609.9019 3635412
+598.909 2264745
+775.5467 2217744
+
+NAME:C049
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:548.99
+Num Peaks:6
+637.3061 40025984
+638.3092 14899454
+654.3336 5820376
+659.2881 4514707
+639.3125 2997621
+655.3356 2193767
+
+NAME:C050
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:562.13
+Num Peaks:6
+335.167 30837870
+376.1936 9206685
+336.1723 5451925
+281.2478 1427835
+665.4442 1293707
+339.1624 1173554
+
+NAME:C051
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:456.67
+Num Peaks:6
+299.6334 26082055
+566.3211 20198673
+1090.6457 6272992
+567.3244 5871222
+291.6451 4435338
+1085.656 2558054
+
+NAME:C052
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:478.9
+Num Peaks:6
+536.308 48824542
+353.0562 14621952
+537.3106 11482454
+256.0036 7683803
+297.1488 7327555
+127.2741 3285476
+
+NAME:C053
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:500.02
+Num Peaks:6
+468.3899 33971049
+609.34 9554282
+604.3847 8198417
+605.413 7101524
+610.3361 3888670
+606.4209 1836398
+
+NAME:C054
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:491.71
+Num Peaks:6
+399.2528 20584280
+395.2774 12115107
+313.1321 10599434
+163.0757 4155052
+335.1258 3732806
+365.1362 2964850
+
+NAME:C055
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:38.64
+Num Peaks:5
+150.9966 13505497
+280.0989 11446380
+148.083 6444124
+258.0099 3216933
+278.8998 1588478
+
+NAME:C056
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:50.55
+Num Peaks:5
+315.08 444337895
+316.0837 48279316
+247.0975 42192032
+235.0874 30725201
+143.0804 9023795
+
+NAME:C057
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:39.38
+Num Peaks:5
+138.05 11589913
+274.8004 7399559
+386.7156 5744862
+504.6304 5051649
+584.623 2769986
+
+NAME:C058
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:37.83
+Num Peaks:5
+136.0489 91083916
+400.7495 6533309
+410.7787 4155900
+542.6812 3135865
+528.7721 2343823
+
+NAME:C059
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:38.84
+Num Peaks:5
+209.0731 140532642
+490.8177 16128577
+208.0701 7862862
+192.0572 5685906
+373.9241 1194415
+
+NAME:C060
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:521.59
+Num Peaks:5
+668.4305 8028504
+1192.2996 4150468
+669.4357 4028528
+930.1118 2367648
+931.117 1841159
+
+NAME:C061
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:573.21
+Num Peaks:5
+265.2529 9899139
+371.2519 8233366
+226.6269 3415692
+266.2547 1785474
+701.5302 1157410
+
+NAME:C062
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:404.94
+Num Peaks:5
+353.2304 32739905
+277.2131 11416355
+296.2306 10660434
+373.2739 9818194
+272.2095 7792653
+
+NAME:C063
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:388.92
+Num Peaks:5
+585.271 56140774
+586.2757 19804349
+601.2667 3868276
+587.2789 3756282
+292.6357 2008767
+
+NAME:C064
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:477.39
+Num Peaks:5
+518.3223 174628688
+519.326 47361590
+438.2983 22072874
+330.04 9899883
+439.3032 4759535
+
+NAME:C065
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:484.01
+Num Peaks:5
+240.0999 57718485
+679.4209 6413969
+1201.2745 3920305
+1188.7713 3552262
+1057.1551 3001955
+
+NAME:C066
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:477.61
+Num Peaks:5
+508.3589 85631225
+509.3621 29637747
+1031.6491 17237588
+1032.6524 9264007
+769.9668 2034350
+
+NAME:C067
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:496.87
+Num Peaks:5
+556.4425 28755077
+600.4695 19352534
+644.4952 11254491
+557.445 8575104
+601.4722 6487708
+
+NAME:C068
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:446.34
+Num Peaks:5
+357.2789 114727535
+312.1598 48528731
+358.2846 32919178
+313.238 12723416
+359.2915 4641654
+
+NAME:C069
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:431.04
+Num Peaks:5
+327.0085 42852661
+329.0054 41634508
+331.0028 13141699
+252.9981 5112473
+328.0117 4011270
+
+NAME:C070
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:436.01
+Num Peaks:5
+603.2936 12822464
+621.3034 7105990
+597.3036 6280556
+604.2967 4096514
+622.3061 2351379
+
+NAME:C071
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:428.33
+Num Peaks:5
+301.2166 18169090
+325.2163 7069382
+343.2266 2908718
+172.1645 1320296
+205.1767 805534
+
+NAME:C072
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:404.46
+Num Peaks:5
+352.2253 64611107
+300.2174 12961057
+341.2118 3403529
+440.2781 3231404
+318.0913 2035771
+
+NAME:C073
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:39.45
+Num Peaks:4
+132.0911 149213134
+105.1079 25643451
+133.093 9606398
+106.0882 1008121
+
+NAME:C074
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:48.99
+Num Peaks:4
+367.9888 19794460
+368.9907 10577331
+324.0009 6981928
+383.9615 6271699
+
+NAME:C075
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:38.61
+Num Peaks:4
+231.0565 7541254
+395.1564 6383328
+377.132 4900119
+107.0073 3031654
+
+NAME:C076
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:55.64
+Num Peaks:4
+172.9567 33953504
+133.927 12290571
+92.9005 5352672
+108.914 2618921
+
+NAME:C077
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:568.29
+Num Peaks:4
+583.8869 36863018
+749.0231 12396899
+584.891 12016606
+750.0278 7401510
+
+NAME:C078
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:398.62
+Num Peaks:4
+316.248 46844363
+340.2484 7340552
+360.2746 2404874
+384.2747 2390732
+
+NAME:C079
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:385.1
+Num Peaks:4
+314.2328 55972011
+315.2342 9937448
+261.1103 8569525
+338.2334 3234158
+
+NAME:C080
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:410.4
+Num Peaks:4
+225.1924 28100176
+226.1948 3835768
+647.2353 2107218
+649.2515 1886834
+
+NAME:C081
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:367.91
+Num Peaks:4
+271.2061 11931733
+505.1464 7616256
+253.1952 3853260
+283.2425 2898656
+
+NAME:C082
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:379.79
+Num Peaks:4
+466.3171 7929750
+430.2953 5331329
+412.2849 4835668
+467.3198 2167391
+
+NAME:C083
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:469.39
+Num Peaks:4
+1015.672 36276276
+1016.676 19226871
+535.3019 10075790
+207.1969 3373287
+
+NAME:C084
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:502.62
+Num Peaks:4
+473.3452 10623724
+517.3716 8926693
+458.3479 6136032
+590.4116 3279579
+
+NAME:C085
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:505.7
+Num Peaks:4
+426.3579 107580438
+400.339 54213917
+427.3613 29338788
+401.3452 13221351
+
+NAME:C086
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:440.16
+Num Peaks:4
+284.1286 13622785
+230.2479 7797320
+417.3195 4847876
+214.2533 1493815
+
+NAME:C087
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:437.62
+Num Peaks:4
+476.2963 13371322
+394.2904 10535151
+471.7966 5456746
+540.3676 4228098
+
+NAME:C088
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:430.41
+Num Peaks:4
+348.9906 5939980
+350.9873 5719912
+426.1135 590428
+428.1109 573856
+
+NAME:C089
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:407.21
+Num Peaks:4
+158.1543 12609020
+374.2762 3731741
+391.209 1174675
+159.1576 1084056
+
+NAME:C090
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:38.56
+Num Peaks:3
+104.1071 417600412
+98.919 34309379
+137.0709 19389252
+
+NAME:C091
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:41.11
+Num Peaks:3
+94.0648 29912950
+110.0706 3533397
+96.0453 2810684
+
+NAME:C092
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:47.76
+Num Peaks:3
+195.0878 229226763
+181.0711 22419168
+196.0894 20952137
+
+NAME:C093
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:43.24
+Num Peaks:3
+286.2015 11316338
+153.0676 6096061
+304.2116 3065540
+
+NAME:C094
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:59.41
+Num Peaks:3
+346.0096 208562691
+302.02 42982160
+344.0145 12088963
+
+NAME:C095
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:17.88
+Num Peaks:3
+287.8894 13522201
+246.8615 7541207
+305.9005 3724287
+
+NAME:C096
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:18.25
+Num Peaks:3
+241.8884 9750879
+259.8949 3972734
+304.8923 2897534
+
+NAME:C097
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:17.2
+Num Peaks:3
+111.9685 52093481
+294.8639 3662077
+88.9319 1738316
+
+NAME:C098
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:520.97
+Num Peaks:3
+320.168 7908369
+314.0269 3344905
+321.1683 2715496
+
+NAME:C099
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:513.8
+Num Peaks:3
+228.2326 6233400
+268.2658 2396656
+220.1175 1361371
+
+NAME:C100
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:589.95
+Num Peaks:3
+810.6019 170332070
+732.5543 29332289
+733.5576 12786143
+
+NAME:C101
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:596.5
+Num Peaks:3
+378.2092 6124105
+663.4541 1495638
+325.2922 966346
+
+NAME:C102
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:568.65
+Num Peaks:3
+235.1326 4646021
+236.1305 1698666
+190.0013 1371611
+
+NAME:C103
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:535.76
+Num Peaks:3
+263.2373 9502360
+614.4833 2200287
+658.51 2078188
+
+NAME:C104
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:531.01
+Num Peaks:3
+466.33 13287998
+467.3202 3787115
+237.22 1561112
+
+NAME:C105
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:351.57
+Num Peaks:3
+363.2171 20574377
+364.2205 4609697
+361.2015 3929265
+
+NAME:C106
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:358.55
+Num Peaks:3
+288.2172 21440274
+311.2052 7425805
+332.2433 6088330
+
+NAME:C107
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:402.91
+Num Peaks:3
+583.2564 11666865
+633.2562 5502961
+584.2607 4806507
+
+NAME:C108
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:388.14
+Num Peaks:3
+274.2123 89701347
+416.3167 18882679
+284.9615 3063470
+
+NAME:C109
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:449.77
+Num Peaks:3
+266.6214 6852794
+361.2739 5667417
+489.1806 1695863
+
+NAME:C110
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:469.09
+Num Peaks:3
+454.2933 89940088
+455.2967 19108220
+436.2823 1402683
+
+NAME:C111
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:475.44
+Num Peaks:3
+515.3077 11336664
+596.2657 6107659
+599.4392 1882543
+
+NAME:C112
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:480.9
+Num Peaks:3
+424.3453 65681466
+425.3459 16618174
+448.3429 4650811
+
+NAME:C113
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:507.69
+Num Peaks:3
+283.2017 5499746
+261.2422 1470485
+369.1252 1397276
+
+NAME:C114
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:500.04
+Num Peaks:3
+111.5221 8871153
+109.5218 8470191
+469.3939 8286428
+
+NAME:C115
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:498.95
+Num Peaks:3
+239.1464 2483711
+390.3208 1535784
+259.1161 653696
+
+NAME:C116
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:455.37
+Num Peaks:3
+229.0895 4621754
+354.2842 3818861
+257.2238 2133166
+
+NAME:C117
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:425.37
+Num Peaks:3
+356.2801 11507639
+177.0628 3105367
+245.0854 1520439
+
+NAME:C118
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:439.21
+Num Peaks:3
+380.2567 13628316
+382.2719 3659980
+264.2696 3219638
+
+NAME:C119
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:75.44
+Num Peaks:2
+267.043 3378727
+244.0267 1028121
+
+NAME:C120
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:38.24
+Num Peaks:2
+130.0494 15956803
+239.9654 1459631
+
+NAME:C121
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:35.65
+Num Peaks:2
+468.745 4564703
+465.8067 2674183
+
+NAME:C122
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:42.78
+Num Peaks:2
+246.1704 11953696
+232.1548 11289500
+
+NAME:C123
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:40.19
+Num Peaks:2
+149.9462 11520115
+102.0359 2328253
+
+NAME:C124
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:40.7
+Num Peaks:2
+147.0736 18882528
+229.1558 16017750
+
+NAME:C125
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:35.04
+Num Peaks:2
+276.896 10711749
+271.9473 2149468
+
+NAME:C126
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:36.81
+Num Peaks:2
+140.0669 214841376
+141.0353 15611039
+
+NAME:C127
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:17.03
+Num Peaks:2
+277.8643 3798476
+295.8715 2325241
+
+NAME:C128
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:317.37
+Num Peaks:2
+286.2016 21614042
+287.2049 3344526
+
+NAME:C129
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:520.57
+Num Peaks:2
+1205.3044 6938899
+943.6165 3052234
+
+NAME:C130
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:511.04
+Num Peaks:2
+341.2854 4773092
+269.983 889010
+
+NAME:C131
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:584.44
+Num Peaks:2
+111.0204 81745635
+139.9881 60275297
+
+NAME:C132
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:594.5
+Num Peaks:2
+241.1402 2703532
+253.2523 948549
+
+NAME:C133
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:587.56
+Num Peaks:2
+134.1177 233169113
+135.1211 15007034
+
+NAME:C134
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:586.91
+Num Peaks:2
+118.1228 927034767
+100.1122 314050032
+
+NAME:C135
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:587
+Num Peaks:2
+101.1156 19921503
+90.0915 18125403
+
+NAME:C136
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:586.09
+Num Peaks:2
+125.0745 5222472
+284.3251 3483102
+
+NAME:C137
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:567.43
+Num Peaks:2
+572.8946 4699172
+573.9011 965749
+
+NAME:C138
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:567.99
+Num Peaks:2
+571.8874 9632225
+737.0252 3438536
+
+NAME:C139
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:569.1
+Num Peaks:2
+467.2343 5702586
+354.2721 3585655
+
+NAME:C140
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:561.51
+Num Peaks:2
+428.3739 27323731
+454.3894 5088107
+
+NAME:C141
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:536.31
+Num Peaks:2
+333.1517 8840004
+334.1551 1501440
+
+NAME:C142
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:543.48
+Num Peaks:2
+383.188 14719171
+384.1866 3279849
+
+NAME:C143
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:548.78
+Num Peaks:2
+387.1432 12915848
+407.6598 4564346
+
+NAME:C144
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:553.62
+Num Peaks:2
+359.1781 45383099
+360.185 9704481
+
+NAME:C145
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:545.31
+Num Peaks:2
+443.3331 1151694
+394.3559 432819
+
+NAME:C146
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:551.39
+Num Peaks:2
+350.1838 4199726
+365.2288 1932289
+
+NAME:C147
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:563.22
+Num Peaks:2
+282.2792 241362345
+256.2615 19433189
+
+NAME:C148
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:548.47
+Num Peaks:2
+305.2468 9633582
+329.249 5814756
+
+NAME:C149
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:350.93
+Num Peaks:2
+130.0643 7419216
+190.0865 4433780
+
+NAME:C150
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:365.37
+Num Peaks:2
+490.2083 5275418
+465.1226 1763287
+
+NAME:C151
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:394.87
+Num Peaks:2
+328.2481 11119434
+329.2519 2068394
+
+NAME:C152
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:385.78
+Num Peaks:2
+427.1607 2275086
+409.1497 1369551
+
+NAME:C153
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:401.39
+Num Peaks:2
+107.0557 2271180
+197.1612 1286942
+
+NAME:C154
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:388.72
+Num Peaks:2
+239.1276 1743749
+286.9585 1645545
+
+NAME:C155
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:373.67
+Num Peaks:2
+507.1617 6285930
+508.1657 1535734
+
+NAME:C156
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:378.37
+Num Peaks:2
+777.6928 4522421
+257.2254 3302868
+
+NAME:C157
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:473.08
+Num Peaks:2
+534.2949 13399261
+267.6425 11780168
+
+NAME:C158
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:508.15
+Num Peaks:2
+380.2992 5790633
+423.2518 1386850
+
+NAME:C159
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:471.89
+Num Peaks:2
+304.2357 21716257
+306.1523 8327492
+
+NAME:C160
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:465.45
+Num Peaks:2
+295.1974 20379534
+193.1239 1274413
+
+NAME:C161
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:488.7
+Num Peaks:2
+667.4214 3075774
+1189.7766 2040172
+
+NAME:C162
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:471.97
+Num Peaks:2
+393.2201 8389493
+316.6601 7221684
+
+NAME:C163
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:465.16
+Num Peaks:2
+431.3157 12163271
+422.3267 4962906
+
+NAME:C164
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:474.29
+Num Peaks:2
+398.3268 11918127
+239.1779 8236995
+
+NAME:C165
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:477.74
+Num Peaks:2
+307.15 1941191
+249.1858 1576729
+
+NAME:C166
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:494.51
+Num Peaks:2
+355.2846 54372680
+373.2951 6108864
+
+NAME:C167
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:497.67
+Num Peaks:2
+474.3486 2732000
+649.4483 2434649
+
+NAME:C168
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:498.02
+Num Peaks:2
+539.4163 5285541
+459.2569 3550909
+
+NAME:C169
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:492.45
+Num Peaks:2
+732.5452 4526953
+733.5465 1043642
+
+NAME:C170
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:497.3
+Num Peaks:2
+451.3631 6446370
+450.3586 4210116
+
+NAME:C171
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:467.81
+Num Peaks:2
+185.0776 5067455
+200.203 1398415
+
+NAME:C172
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:457.02
+Num Peaks:2
+263.2347 3933284
+615.2633 1132491
+
+NAME:C173
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:443.89
+Num Peaks:2
+370.2956 41596161
+371.304 9966707
+
+NAME:C174
+IONMODE:Negative
+SPECTRUMTYPE:Centroid
+RETENTIONTIME:438.81
+Num Peaks:2
+579.2938 6044865
+330.2563 5274387
+