0  B13R0.336  OCCCCCCCCCCCCBr DB02619 [0,0,0,0,0,0|1,0,2]=3
1  B12R0.5  CCCCCCCCCCCCO DB06894 [1,0,0,0,0,0|0,0,1]=2
2  B12R0.5  CCCCCCCCCCOC=O DB07650 [1,0,0,0,0,0|1,0,0]=2
3  B12R0.5  CCCCCCCCCCOCO DB04082 [1,0,0,0,0,0|1,0,1]=3
4  B14R0.392  NCCCCCCNCCCCCCN DB04684 [0,1,0,0,0,0|2,0,1]=4
5  B14R0.394  CCCCCCCCCCCCC(=O)O DB02448 [0,1,0,0,0,0|0,0,0]=1
6  B14R0.394  O=C(O)CCCCCCCCCCCBr DB02405 [0,1,0,0,0,0|1,0,0]=2
7  B14R0.394  O=C(O)CCCCCCCCCCCO DB03704 [0,1,0,0,0,0|1,0,0]=2
8  B11R0.3  CCCCCCCCCCC=O DB04093 [2,0,0,0,0,0|0,0,0]=2
9  B13R0.54  CCCCCCCCCCCC(=O)O DB03017 [1,1,0,0,0,0|0,0,0]=2
10  B13R0.54  CCCCCCCCCCOC(=O)S DB08684 [1,1,0,0,0,0|1,0,0]=3
11  B13R0.54  O=C(O)CCCCCCCCCCS DB08171 [1,1,0,0,0,0|1,0,0]=3
12  B15R0.84  [C@H](N)(CSCCCCCCCCC)C(=O)O DB07849 [0,2,0,0,0,0|1,0,0]=3
13  B15R0.164  CCCCCCCCCCCCCC(=O)O DB08231 [0,2,0,0,0,0|0,0,0]=2
14  B15R0.252  CCCCCCCCCCCCS(=O)(=O)[O-] DB07681 [0,2,0,0,0,0|1,0,0]=3
15  B15R0.252  CCCCCCCCCCCC[N+](C)(C)C DB02779 [0,2,0,0,0,0|2,0,0]=4
16  B15R0.252  CCCCCCCCCCCC[N+](C)(C)[O-] DB04147 [0,2,0,0,0,0|1,0,1]=4
17  B15R1.253  [C@H]1(N)CCCCCCCCCCNC1=O DB08476 [0,1,0,1,0,0|1,0,0]=3