0  B3R0.2  CC(C)Br A2Z00093522 [0,0,0,0,0,0|3,0,1]=4
1  B3R0.2  CC(C)N A2Z00093481 [0,0,0,0,0,0|2,0,1]=3
2  B3R0.2  CN(C)N A2Z00049168 [0,0,0,0,0,0|3,0,0]=3
3  B2R0.1  C(Br)Br A2Z00093572 [1,0,0,0,0,0|2,0,1]=4
4  B2R0.1  CC=O A2Z00093597 [1,0,0,0,0,0|1,0,0]=2
5  B2R0.1  CON A2Z00047974 [1,0,0,0,0,0|2,0,0]=3
6  B4R0.1  C(=N)(N)NN A2Z00038637 [0,1,0,0,0,0|1,0,0]=2
7  B4R0.1  C(C(=O)Cl)Cl A2Z00093506 [0,1,0,0,0,0|2,0,0]=3
8  B4R0.1  CC(=O)CO A2Z00094832 [0,1,0,0,0,0|2,0,0]=3
9  B4R0.1  CCC(=O)N A2Z00097941 [0,1,0,0,0,0|1,0,0]=2
10  B4R0.1  COC(=O)Cl A2Z00093492 [0,1,0,0,0,0|2,0,0]=3
11  B4R0.1  C[C@@H](CO)N A2Z00045067 [0,1,0,0,0,0|1,0,2]=4
12  B3R0.1  C(=N\O)/N A2Z00096515 [1,1,0,0,0,0|0,0,1]=3
13  B3R0.1  C(=O)NN A2Z00049575 [1,1,0,0,0,0|0,0,0]=2
14  B3R0.1  C(CS)N A2Z00095999 [1,1,0,0,0,0|0,1,1]=4
15  B3R0.1  C=CCBr A2Z00093514 [1,1,0,0,0,0|2,0,0]=4
16  B3R0.1  CCCN A2Z00093482 [1,1,0,0,0,0|1,0,1]=4
17  B5R0.1  C(C#N)C(=O)N A2Z00096074 [0,2,0,0,0,0|0,0,1]=3
18  B5R0.1  C(C#N)C(=O)O A2Z00093469 [0,2,0,0,0,0|1,0,1]=4
19  B5R0.1  C(C#N)C(=S)N A2Z00033541 [0,2,0,0,0,0|0,1,1]=4
20  B5R0.1  C(CBr)C(=O)N A2Z00070352 [0,2,0,0,0,0|1,0,0]=3
21  B5R0.1  CC(=O)CCN A2Z00069826 [0,2,0,0,0,0|1,0,0]=3
22  B5R0.1  CCCC(=O)O A2Z00093490 [0,2,0,0,0,0|2,0,0]=4
23  B5R0.1  CNCC(=O)O A2Z00095987 [0,2,0,0,0,0|1,0,0]=3
24  B5R0.1  COCC(=O)Cl A2Z00094312 [0,2,0,0,0,0|2,0,0]=4
25  B5R0.1  CSCC(=N)N A2Z00074300 [0,2,0,0,0,0|0,1,1]=4
26  B5R0.3  C(C(=O)C=O)O A2Z00050060 [0,2,0,0,0,0|2,0,0]=4
27  B5R0.3  COC(=O)C#N A2Z00050483 [0,2,0,0,0,0|1,0,1]=4
28  B5R0.3  COC(=O)C=C A2Z00093487 [0,2,0,0,0,0|2,0,0]=4
29  B5R0.3  COC(=O)CI A2Z00098171 [0,2,0,0,0,0|2,0,0]=4
30  B5R0.4  CCS(=O)(=O)N A2Z00094833 [0,2,0,0,0,0|2,0,0]=4
31  B5R0.4  CNS(=O)(=O)Cl A2Z00048833 [0,2,0,0,0,0|2,0,0]=4
32  B5R0.4  CS(=O)(=O)NO A2Z00094627 [0,2,0,0,0,0|2,0,0]=4
33  B5R0.5  CC(=O)N(C)N A2Z00094878 [0,2,0,0,0,0|1,0,0]=3
34  B5R0.5  CC(C(=O)C)Cl A2Z00093500 [0,2,0,0,0,0|2,0,0]=4
35  B5R0.5  CC(C(=O)N)Cl A2Z00098040 [0,2,0,0,0,0|1,0,0]=3
36  B5R0.5  CN(C)C(=O)Cl A2Z00096010 [0,2,0,0,0,0|1,0,0]=3
37  B5R1.2  C1C(=O)CO1 A2Z00096164 [0,1,0,1,0,0|2,0,0]=4