0  B9R1.8  NCCC1=CC=CC=C1 YMDB01558 [0,0,0,0,0,0|0,0,0]=0
1  B9R1.8  O=CCC1=CC=CC=C1 YMDB00116 [0,0,0,0,0,0|1,0,1]=2
2  B9R1.8  OCCC1=CC=CC=C1 YMDB01072 [0,0,0,0,0,0|1,0,0]=1
3  B8R1.2  O=CC1=CC=CC=C1 YMDB01326 [1,0,0,0,0,0|1,0,1]=3
4  B8R1.2  OCC1=CC=CC=C1 YMDB01426 [1,0,0,0,0,0|1,0,0]=2
5  B10R1.1  CCCC1=NC=C(C)N=C1 YMDB01504 [0,1,0,0,0,0|3,0,0]=4
6  B10R1.1  NCCC1=CC=C(O)C=C1 YMDB01797 [0,1,0,0,0,0|0,0,0]=1
7  B10R1.1  OCCC1=CC=C(O)C=C1 YMDB01798 [0,1,0,0,0,0|1,0,0]=2
8  B10R1.4  OCCC1=CC=CC=C1O YMDB02314 [0,1,0,0,0,0|1,0,0]=2
9  B10R1.15  N#CC(O)C1=CC=CC=C1 YMDB01642 [0,1,0,0,0,0|0,0,2]=3
10  B10R1.17  O=C\C=C\C1=CC=CC=C1 YMDB01654 [0,1,0,0,0,0|1,0,2]=4
11  B10R1.18  CC(=O)OC1=CC=CC=C1 YMDB00838 [0,1,0,0,0,0|2,0,1]=4
12  B10R1.18  O=C(O)CC1=CC=CC=C1 YMDB00891 [0,1,0,0,0,0|1,0,1]=3
13  B10R2.7  C1=CC=C2SC=NC2=C1 YMDB01432 [0,0,0,1,0,0|1,0,2]=4
14  B8R1.8  NCCC1=CNC=N1 YMDB01556 [0,0,0,0,1,0|2,0,0]=3
15  B8R1.8  SCCC1=CC=CO1 YMDB01460 [0,0,0,0,1,0|2,0,0]=3
16  B7R1.3  CC1=NC=CC=C1 YMDB01458 [2,0,0,0,0,0|1,0,0]=3
17  B9R0.45  CCCC\C=C\C=C\C=O YMDB01795 [0,1,1,0,0,0|1,0,1]=4
18  B9R1.1  C=CC1=CC=C(O)C=C1 YMDB01627 [1,1,0,0,0,0|0,0,2]=4
19  B9R1.1  CCC1=CC=C(O)C=C1 YMDB01617 [1,1,0,0,0,0|0,0,0]=2
20  B9R1.6  CC(=O)C1=CC=CC=C1 YMDB01629 [1,1,0,0,0,0|0,0,1]=3
21  B9R1.6  NC(=O)C1=CC=CN=C1 YMDB00274 [1,1,0,0,0,0|1,0,1]=4
22  B9R1.6  O=C(O)C1=CC=CC=C1 YMDB02301 [1,1,0,0,0,0|1,0,1]=4
23  B9R1.15  COC1=CC=CC=C1O YMDB01430 [1,1,0,0,0,0|1,0,0]=3
24  B11R1.20  O=C(O)CC1=CC=C(O)C=C1 YMDB01486 [0,2,0,0,0,0|1,0,1]=4
25  B7R1.1  CCC1=CC=CO1 YMDB01437 [1,0,0,0,1,0|1,0,0]=3
26  B7R1.1  CCC1=NC=CS1 YMDB01505 [1,0,0,0,1,0|2,0,0]=4
27  B7R1.1  CSC1=CSC=C1 YMDB01449 [1,0,0,0,1,0|2,0,0]=4
28  B7R1.1  OCC1=CC=CS1 YMDB01447 [1,0,0,0,1,0|2,0,0]=4
29  B7R1.1  SCC1=CC=CO1 YMDB01433 [1,0,0,0,1,0|2,0,0]=4