0  B9R1.69  CC1=CNC(=O)NC1=O M18962 [0,0,0,0,0,0|2,0,1]=3
1  B9R1.69  Cc1ccc(N)c(N)c1 M21552 [0,0,0,0,0,0|4,0,0]=4
2  B9R1.69  Cc1ccc(O)c(N)c1 M28689 [0,0,0,0,0,0|4,0,0]=4
3  B9R1.69  NC1=C(F)C=NC(=O)N1 M13149 [0,0,0,0,0,0|0,0,0]=0
4  B9R1.69  O=C1NC=C(Br)C(=O)N1 M21286 [0,0,0,0,0,0|1,1,1]=3
5  B9R1.69  O=C1NC=C(F)C(=O)N1 M14770 [0,0,0,0,0,0|1,0,1]=2
6  B8R1.3  NC1=CC=C(F)C=C1 M19500 [1,0,0,0,0,0|3,0,0]=4
7  B8R1.3  Nc1ccc(Cl)nc1 M20685 [1,0,0,0,0,0|3,0,0]=4
8  B8R1.3  O=C1C=CC(=O)C=C1 M20231 [1,0,0,0,0,0|3,0,0]=4
9  B8R1.4  O=C1C=CNC(=O)N1 M15525 [1,0,0,0,0,0|1,0,1]=3
10  B8R1.4  O=C1C=CNC(=S)N1 M11751 [1,0,0,0,0,0|1,1,1]=4
11  B8R1.5  NC1=CC=CC=C1I M24615 [1,0,0,0,0,0|2,1,0]=4
12  B8R1.5  Nc1ccccc1O M19714 [1,0,0,0,0,0|3,0,0]=4
13  B8R1.5  Nc1ccncc1N M18788 [1,0,0,0,0,0|2,0,0]=3
14  B8R1.5  Nc1ncccc1O M21226 [1,0,0,0,0,0|2,0,1]=4
15  B10R1.22  O=C1NC(=O)C(=O)C(=O)N1 M21082 [0,1,0,0,0,0|2,0,1]=4
16  B10R1.25  Nc1nc(O)ncc1CO M28031 [0,1,0,0,0,0|1,0,2]=4
17  B8R1.18  BrC1=NC(Br)=C(Br)N1 M29531 [0,0,0,0,1,0|2,1,0]=4
18  B7R1.3  NC1=CC=NC=C1 M14717 [2,0,0,0,0,0|1,0,0]=3
19  B7R1.3  Nc1ccccc1 M19715 [2,0,0,0,0,0|2,0,0]=4
20  B9R1.2  NCc1ccnc(Cl)c1 M20701 [1,1,0,0,0,0|2,0,0]=4
21  B9R1.37  O=C1NC(=O)C(Br)=C1Br M29525 [0,1,0,0,1,0|1,1,0]=4
22  B7R1.2  O=C1C=CC(=O)N1 M19624 [1,0,0,0,1,0|2,0,0]=4