0  B4R0.1  C=C[C@H](C)N N11431 [0,1,0,0,0,0|2,0,1]=4
1  B4R0.1  C[C@H](N)C#N 96735 [0,1,0,0,0,0|2,0,1]=4
2  B4R0.1  C[C@H](N)CF AC1331 [0,1,0,0,0,0|2,0,1]=4
3  B4R0.1  NC(=S)CF E70025 [0,1,0,0,0,0|1,1,0]=3
4  B5R0.1  CN(C)NC=O 20013 [0,2,0,0,0,0|2,0,0]=4
5  B5R0.4  O=S(=O)(Cl)CBr AT12635 [0,2,0,0,0,0|1,0,1]=4
6  B5R0.5  CC(N)C(C)O Y13729 [0,2,0,0,0,0|1,0,1]=4
7  B5R0.5  C[C@H](N)[C@H](C)O F16993 [0,2,0,0,0,0|1,0,1]=4
8  B5R1.4  N[C@H]1C[C@@H]1O C93527 [0,1,0,1,0,0|1,0,1]=4
9  B5R1.5  NC1(O)CC1 92034 [0,1,0,1,0,0|1,0,1]=4