0  B5R0.1  CCCC(=O)O DB03568 [0,0,0,0,0,0|2,0,1]=3
1  B5R0.1  CNCC(=O)O DB12519 [0,0,0,0,0,0|3,0,1]=4
2  B4R0.1  CC(O)CO DB01839 [1,0,0,0,0,0|0,0,0]=1
3  B4R0.1  CC[C@@H](C)O DB02606 [1,0,0,0,0,0|0,0,0]=1
4  B4R0.1  O=C(O)CO DB03085 [1,0,0,0,0,0|1,0,1]=3
5  B6R0.3  N[C@H](CO)C(=O)O DB03929 [0,1,0,0,0,0|1,0,1]=3
6  B6R0.4  NCCCC(=O)O DB02530 [0,1,0,0,0,0|2,0,1]=4
7  B6R0.4  O=C([O-])CCCO DB01440 [0,1,0,0,0,0|1,0,2]=4
8  B6R0.5  C[N+](C)([11CH3])CCO DB09277 [0,1,0,0,0,0|2,0,0]=3
9  B6R0.5  O=S(=O)(O)CCS DB09110 [0,1,0,0,0,0|2,1,0]=4
10  B3R0.1  NCCS DB00847 [2,0,0,0,0,0|1,1,0]=4
11  B3R0.2  CC(C)O DB02325 [2,0,0,0,0,0|0,0,0]=2
12  B3R0.2  O=[Se](O)O DB11127 [2,0,0,0,0,0|2,0,0]=4
13  B5R0.3  OCC(O)CO DB09462 [1,1,0,0,0,0|0,0,0]=2
14  B5R0.5  CC(O)C(=O)[O-] DB13231 [1,1,0,0,0,0|0,0,2]=4
15  B7R0.2  NC[C@@H](F)C[PH](=O)O DB11920 [0,2,0,0,0,0|2,0,0]=4
16  B7R0.11  [C-]#[N+]CC(C)(C)OC DB09161 [0,2,0,0,0,0|2,0,0]=4
17  B7R1.3  NC1CCCCC1 DB04996 [0,1,0,1,0,0|2,0,0]=4