0  B7R1.1  ClCC1=CSC=N1 3662 [0,0,0,0,0,0|3,0,0]=3
1  B6R1.2  BrC1=NC=CN1 2531 [1,0,0,0,0,0|3,0,0]=4
2  B6R1.2  CC1=COC=N1 3117 [1,0,0,0,0,0|2,0,0]=3
3  B8R1.8  NCCN1C=CC=N1 760 [0,1,0,0,0,0|2,0,0]=3
4  B8R1.8  NCCN1C=CN=C1 761 [0,1,0,0,0,0|3,0,0]=4
5  B8R1.11  CCN1N=CC=C1N 2314 [0,1,0,0,0,0|2,0,0]=3
6  B5R0.3  C=C[C@@H](O)CO 4518 [1,0,1,0,0,0|1,0,1]=4
7  B7R0.3  CCC(=O)\C=C\C=O 4517 [0,1,1,0,0,0|0,0,1]=3
8  B9R1.2  COC1=CC(Cl)=NC=N1 370 [0,1,0,0,0,1|2,0,0]=4
9  B9R1.2  CSC1=CC=NC(Cl)=N1 373 [0,1,0,0,0,1|2,0,0]=4
10  B9R1.2  CSC1=NC=CC(=O)N1 2006 [0,1,0,0,0,1|2,0,0]=4
11  B9R1.7  NCCC1=CSC(N)=N1 904 [0,2,0,0,0,0|2,0,0]=4