0  B5R0.4  CC(C)(C)C#N CM14136 [0,0,0,0,0,0|2,0,1]=3
1  B5R0.4  CC(C)(C)C=O CM10011 [0,0,0,0,0,0|2,0,0]=2
2  B5R0.4  CC(C)(CN)N CM11082 [0,0,0,0,0,0|2,0,1]=3
3  B5R0.4  CC(C)(CN)S CM13886 [0,0,0,0,0,0|1,1,1]=3
4  B4R0.1  CC=C(C)Br CM14455 [1,0,0,0,0,0|1,0,2]=4
5  B4R0.1  C[C@@H](CN)N CM14368 [1,0,0,0,0,0|2,0,1]=4
6  B4R0.1  C[C@H](CN)N CM14342 [1,0,0,0,0,0|2,0,1]=4
7  B3R0.1  C=CC=O CM11306 [2,0,0,0,0,0|0,0,2]=4
8  B3R0.2  CC(=S)O CM13905 [2,0,0,0,0,0|1,0,1]=4
9  B5R0.5  CC(C(=O)O)F CM13749 [1,1,0,0,0,0|2,0,0]=4
10  B7R0.14  CC(C)(C(=O)OC)F CM13900 [0,2,0,0,0,0|1,0,1]=4
11  B7R0.14  CC(C)(C(=O)OC)O CM11022 [0,2,0,0,0,0|0,0,1]=3
12  B7R0.13  C[C@@](CS)(C(=O)O)N CM11024 [0,2,0,0,0,0|2,0,0]=4
13  B5R1.2  C1C(CN1)O CM14096 [1,0,0,1,0,0|1,0,1]=4
14  B5R1.2  C1C(CO1)O CM14219 [1,0,0,1,0,0|1,0,1]=4
15  B5R1.3  C1CC1CBr CM13343 [1,0,0,1,0,0|1,0,1]=4