0  B5R0.5  CC(C(=O)O)F CM13749 [0,0,0,0,0,0|2,1,1]=4
1  B4R0.1  CC=C(C)Br CM14455 [1,0,0,0,0,0|1,0,2]=4
2  B4R0.1  C[C@@H](CN)N CM14368 [1,0,0,0,0,0|2,0,0]=3
3  B4R0.1  C[C@H](CN)N CM14342 [1,0,0,0,0,0|2,0,0]=3
4  B6R1.11  C1CC1C(=O)Cl CM13883 [0,0,0,1,0,0|1,1,1]=4
5  B5R0.1  CC(CCO)N CM14429 [1,1,0,0,0,0|1,0,0]=3
6  B5R0.4  CC(C)(C)C#N CM14136 [1,1,0,0,0,0|1,0,1]=4
7  B5R0.4  CC(C)(C)C=O CM10011 [1,1,0,0,0,0|0,1,1]=4
8  B5R0.4  CC(C)(CN)N CM11082 [1,1,0,0,0,0|1,0,0]=3
9  B5R0.4  CC(C)(CN)S CM13886 [1,1,0,0,0,0|1,0,0]=3
10  B7R0.14  CC(C)(C(=O)OC)F CM13900 [0,2,0,0,0,0|0,1,1]=4
11  B7R0.14  CC(C)(C(=O)OC)O CM11022 [0,2,0,0,0,0|0,1,1]=4
12  B5R1.2  C1C(CN1)F CM14271 [1,0,0,1,0,0|2,0,0]=4
13  B5R1.2  C1C(CN1)O CM14096 [1,0,0,1,0,0|1,1,0]=4
14  B5R1.2  C1C(CO1)I CM14229 [1,0,0,1,0,0|1,1,0]=4
15  B5R1.2  C1C(CO1)N CM14221 [1,0,0,1,0,0|1,1,0]=4
16  B5R1.2  C1C(CO1)O CM14219 [1,0,0,1,0,0|1,1,0]=4
17  B5R1.2  C1CC(=O)C1 CM14132 [1,0,0,1,0,0|0,1,1]=4
18  B5R1.3  C1CC1CBr CM13343 [1,0,0,1,0,0|1,0,0]=3
19  B7R1.2  C1C[C@H](C[C@@H]1N)O CM10407 [0,0,0,1,0,1|1,1,0]=4
20  B7R1.22  C1CC1C(=O)CBr CM11136 [0,1,0,1,0,0|0,1,1]=4