0  B5R0.1  CC(CCO)N CM14429 [0,0,0,0,0,0|2,0,2]=4
1  B4R0.1  CC=C(C)Br CM14455 [1,0,0,0,0,0|1,0,1]=3
2  B4R0.1  C[C@@H](CN)N CM14368 [1,0,0,0,0,0|2,0,1]=4
3  B4R0.1  C[C@H](CN)N CM14342 [1,0,0,0,0,0|2,0,1]=4
4  B6R0.4  CC(=O)C=COC CM11079 [0,1,0,0,0,0|1,0,1]=3
5  B6R0.5  [B-](C=CC)(F)(F)F CM10069 [0,1,0,0,0,0|3,0,0]=4
6  B6R1.2  C1C=CCC1O CM14094 [0,0,0,1,0,0|1,0,2]=4
7  B6R1.2  C1COCC1Br CM10289 [0,0,0,1,0,0|2,0,1]=4
8  B6R1.2  Cc1cc[nH]n1 CM14373 [0,0,0,1,0,0|2,0,1]=4
9  B6R1.3  C1CC1CC#N CM13687 [0,0,0,1,0,0|1,0,2]=4
10  B6R1.3  C1CC1CCO CM13498 [0,0,0,1,0,0|1,0,2]=4
11  B3R0.1  C=CC=O CM11306 [2,0,0,0,0,0|1,0,1]=4
12  B5R0.4  CC(C)(C)C#N CM14136 [1,1,0,0,0,0|1,0,1]=4
13  B5R0.4  CC(C)(C)C=O CM10011 [1,1,0,0,0,0|1,0,0]=3
14  B5R0.4  CC(C)(CN)N CM11082 [1,1,0,0,0,0|1,0,1]=4
15  B5R0.4  CC(C)(CN)S CM13886 [1,1,0,0,0,0|1,0,1]=4
16  B5R0.5  CC(C(=O)O)F CM13749 [1,1,0,0,0,0|2,0,0]=4
17  B5R0.2  C(C=CCCl)Cl CM14478 [1,1,0,0,0,0|1,0,0]=3
18  B5R0.2  C(C=CCCl)Cl CM14479 [1,1,0,0,0,0|1,0,0]=3
19  B5R0.2  C(C=CCCl)O CM14462 [1,1,0,0,0,0|1,0,0]=3
20  B7R0.14  CC(C)(C(=O)OC)F CM13900 [0,2,0,0,0,0|1,0,0]=3
21  B7R0.14  CC(C)(C(=O)OC)O CM11022 [0,2,0,0,0,0|1,0,0]=3
22  B7R0.4  CC(=O)OC=CCBr CM11056 [0,2,0,0,0,0|1,0,1]=4
23  B7R0.6  CN(C)C=C[N+](=O)[O-] CM10970 [0,2,0,0,0,0|2,0,0]=4
24  B5R1.3  C1CC1CBr CM13343 [1,0,0,1,0,0|1,0,1]=4
25  B5R1.1  C1C=CCN1 CM14480 [1,0,0,1,0,0|1,0,0]=3
26  B7R1.2  Cc1cc(on1)C CM14486 [0,1,0,1,0,0|1,0,1]=4
27  B7R1.22  C1CC1C(=O)CBr CM11136 [0,1,0,1,0,0|1,0,1]=4
28  B7R1.20  C1CC1CC(=O)O CM13686 [0,1,0,1,0,0|1,0,1]=4