0  B6R0.1  COC(=O)CCN T8097 [1,0,0,0,0,0|1,0,0]=2
1  B6R0.1  NCC(=O)O[Ru]Cl T6454 [1,0,0,0,0,0|3,0,0]=4
2  B6R0.6  CC\C=C/CCO T22295 [1,0,0,0,0,0|1,1,0]=3
3  B8R0.5  CCOC(=O)CC(=O)O T4773 [0,1,0,0,0,0|0,1,1]=3
4  B8R0.5  CCOC(=O)CC(=O)[O-] T22328 [0,1,0,0,0,0|0,1,1]=3
5  B8R0.30  CCOP(=O)(O)OCC T7192 [0,1,0,0,0,0|3,0,0]=4
6  B8R1.11  CCN1CCCC1=O T13823 [0,0,0,1,0,0|2,0,0]=3
7  B5R0.1  CCCC(=O)[O-] T1393 [2,0,0,0,0,0|1,0,1]=4
8  B5R0.1  CCOC(N)=O T0051 [2,0,0,0,0,0|1,0,0]=3
9  B5R0.1  CNCC(=O)O T6975 [2,0,0,0,0,0|2,0,0]=4
10  B5R0.1  NCCC(=O)O T0627 [2,0,0,0,0,0|1,0,0]=3
11  B5R0.1  NCCS(=O)O T5225 [2,0,0,0,0,0|2,0,0]=4
12  B5R0.1  NOCC(=O)O T5880 [2,0,0,0,0,0|2,0,0]=4
13  B7R0.2  COC(=O)CC(C)=O T4851 [1,1,0,0,0,0|0,1,1]=4
14  B7R0.3  COC(=O)CCCN T22364 [1,1,0,0,0,0|1,0,0]=3
15  B7R0.10  COC(=O)[C@@H](N)CS T1547 [1,1,0,0,0,0|0,0,0]=2
16  B7R0.1  NCCCNCCS TQ0133 [1,1,0,0,0,0|2,0,0]=4
17  B7R1.3  O=C1CCCCO1 T4821 [1,0,0,1,0,0|0,0,0]=2
18  B7R1.4  C=C1CCOC1=O T5320 [1,0,0,1,0,0|0,0,2]=4
19  B7R1.4  NC1CCSC1=O T5968 [1,0,0,1,0,0|1,1,0]=4
20  B7R1.4  N[C@H]1CCSC1=O T19393 [1,0,0,1,0,0|1,1,0]=4
21  B9R1.66  CC1(O)CCOC(=O)C1 T1353 [0,1,0,1,0,0|0,1,0]=3