Mercurial > repos > marpiech > norwich_tools_dock
comparison test-data/acpc/output_mol2reader @ 3:8c2e85bb2ce9 draft
planemo upload commit 489ad526806f22eefcb73e8d8efe44d648e8185e-dirty
| author | marpiech |
|---|---|
| date | Tue, 20 Sep 2016 09:57:24 -0400 |
| parents | |
| children |
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| 2:958fa7ba4715 | 3:8c2e85bb2ce9 |
|---|---|
| 1 ZINC01061693 0 | |
| 2 -6.617400 -0.336600 -0.518500 -0.173400 | |
| 3 -5.932700 -1.784100 1.290600 -0.249800 | |
| 4 -5.293900 -0.250300 -0.950500 0.005600 | |
| 5 -4.609200 -1.698000 0.858600 0.010800 | |
| 6 -6.936700 -1.103400 0.602000 0.147300 | |
| 7 -4.289800 -0.931000 -0.262000 -0.800000 | |
| 8 -9.633300 0.373800 -0.136100 0.301300 | |
| 9 -2.845300 1.806400 -0.174800 -0.034700 | |
| 10 -1.919600 0.319900 1.552900 -0.034500 | |
| 11 -2.111000 2.958400 0.496500 -0.030800 | |
| 12 -1.224500 1.534600 2.151800 -0.030400 | |
| 13 -9.244500 -1.076500 0.028100 -0.041200 | |
| 14 -2.096500 0.542600 0.088000 -0.841400 | |
| 15 -10.610700 0.550100 -1.090900 -0.430900 | |
| 16 -9.131800 1.289500 0.509600 -0.328400 | |
| 17 -1.915600 -1.994900 -0.329400 -0.915700 | |
| 18 -2.626100 -0.482800 -2.215300 -0.913300 | |
| 19 -1.986800 2.717100 1.899800 -0.270100 | |
| 20 -8.228300 -1.188000 1.023400 -0.171500 | |
| 21 -2.614500 -0.821300 -0.808100 2.766700 | |
| 22 -7.395400 0.195400 -1.059400 0.156600 | |
| 23 -6.175300 -2.383000 2.164100 0.135400 | |
| 24 -5.056300 0.349900 -1.824500 0.154000 | |
| 25 -3.834600 -2.231900 1.402400 0.148300 | |
| 26 -3.858900 1.710300 0.231400 0.102700 | |
| 27 -2.904900 1.985900 -1.252900 0.109700 | |
| 28 -1.310500 -0.573600 1.722300 0.107700 | |
| 29 -2.904500 0.177600 2.012500 0.102600 | |
| 30 -1.114000 3.106800 0.064500 0.071100 | |
| 31 -2.673700 3.888000 0.365500 0.115600 | |
| 32 -1.136700 1.418400 3.236500 0.069200 | |
| 33 -0.213900 1.661400 1.745600 0.114500 | |
| 34 -8.862100 -1.462100 -0.921900 0.097600 | |
| 35 -10.119100 -1.655700 0.339800 0.094900 | |
| 36 -10.993600 -0.240800 -1.598300 0.214100 | |
| 37 -10.984400 1.465100 -1.322600 0.240400 |
