0  B4R0.1  N=C(N)CF 4088189 [0,1,0,0,0,0|2,0,0]=3
1  B5R0.1  COCC(=N)N 4091089 [0,2,0,0,0,0|2,0,0]=4
2  B5R0.3  C=C(CC)CN 4074283 [0,2,0,0,0,0|2,0,0]=4
3  B5R0.3  C=CC(O)CN 4055871 [0,2,0,0,0,0|1,0,1]=4
4  B5R0.3  CNC(=O)CN 4089909 [0,2,0,0,0,0|1,0,0]=3
5  B5R0.3  COC(C)CN 4089925 [0,2,0,0,0,0|1,0,1]=4
6  B5R0.3  CO[C@@H](C)C#N 4030194 [0,2,0,0,0,0|1,0,1]=4
7  B5R0.3  CO[C@@H](C)CO 4031352 [0,2,0,0,0,0|0,0,2]=4
8  B5R0.5  CC(O)C(=N)N 4089130 [0,2,0,0,0,0|1,0,1]=4
9  B5R0.5  C[C@@H](O)C(=N)N 4060246 [0,2,0,0,0,0|1,0,1]=4
10  B5R0.5  C[C@H](O)C(=N)N 4057094 [0,2,0,0,0,0|1,0,1]=4
11  B5R0.5  O=C(O)C(=O)O 4034715 [0,2,0,0,0,0|0,0,1]=3
12  B5R1.2  OC1CNC1 4088745 [0,1,0,1,0,0|1,0,1]=4