0  B9R1.35  CC1=CSC(C(C)C)=N1 YMDB01496 [0,0,0,0,0,0|3,0,1]=4
1  B9R1.35  CC1=NC(C(C)C)=CS1 YMDB01510 [0,0,0,0,0,0|3,0,1]=4
2  B9R1.35  O=C(O)C1=CC=C(O)O1 YMDB02319 [0,0,0,0,0,0|2,0,0]=2
3  B8R1.1  CC1=CC=C(C=O)O1 YMDB01435 [1,0,0,0,0,0|0,0,0]=1
4  B8R1.1  CC1=CC=C(C=O)S1 YMDB01445 [1,0,0,0,0,0|0,1,0]=2
5  B8R1.1  CC1=CC=C(CS)O1 YMDB01503 [1,0,0,0,0,0|0,1,1]=3
6  B8R1.1  CCC1=CN=C(C)S1 YMDB01509 [1,0,0,0,0,0|1,1,1]=4
7  B8R1.7  CC(=O)C1=CC=CS1 YMDB01431 [1,0,0,0,0,0|0,1,0]=2
8  B8R1.7  CC(=O)C1=NC=CS1 YMDB01581 [1,0,0,0,0,0|1,1,0]=3
9  B8R0.28  CC(=O)CCC=C(C)C YMDB00877 [0,0,1,0,0,0|1,0,2]=4
10  B10R1.13  CC(=O)C1=CC=C(C)C=C1 YMDB01619 [0,0,0,0,0,1|1,0,0]=2
11  B10R1.13  NC1=CC=C(C(=O)O)C=C1 YMDB00493 [0,0,0,0,0,1|3,0,0]=4
12  B10R1.13  O=C(O)C1=CC=C(O)C=C1 YMDB00495 [0,0,0,0,0,1|3,0,0]=4
13  B10R1.54  O=C(O)\C=C1/C=CC(=O)O1 YMDB00159 [0,0,0,0,0,1|2,0,0]=3
14  B10R1.113  C[N+]1=CC=CC(C(N)=O)=C1 YMDB00348 [0,0,0,0,0,1|3,0,0]=4
15  B7R0.4  C\C=C\C=C\C(=O)O YMDB01784 [1,0,1,0,0,0|1,0,0]=3
16  B7R1.1  CCC1=CC=CO1 YMDB01437 [2,0,0,0,0,0|0,0,1]=3
17  B7R1.1  O=CC1=CC=CO1 YMDB01459 [2,0,0,0,0,0|0,0,0]=2
18  B7R1.1  SCC1=CC=CO1 YMDB01433 [2,0,0,0,0,0|0,1,1]=4
19  B9R1.22  CCC1=C(C)N=C(C)O1 YMDB01500 [1,1,0,0,0,0|1,0,1]=4
20  B11R1.3  COC1=CC=C(C(=O)O)C=C1 YMDB01638 [0,1,0,0,0,1|2,0,0]=4
21  B11R1.166  CC1=CC=C(C(=O)O)C(C)=C1 YMDB02315 [0,1,0,0,0,1|2,0,0]=4
22  B9R1.6  CC(=O)C1=CC=CC=C1 YMDB01629 [0,0,1,1,0,0|1,0,1]=4
23  B9R1.13  CC(=O)CC1=CC=CO1 YMDB01695 [1,0,0,0,0,1|0,0,0]=2