0  B9R1.35  CC(C)c1cn(cn1)C Molport-004-774-797 [0,0,0,0,0,0|3,0,0]=3
1  B9R1.35  CC(N)c1cn(cn1)C Molport-046-688-100 [0,0,0,0,0,0|3,0,0]=3
2  B9R1.35  CC(N)c1cn(cn1)C Molport-047-589-873 [0,0,0,0,0,0|3,0,0]=3
3  B9R1.35  CC(O)c1cn(cn1)C Molport-021-802-740 [0,0,0,0,0,0|2,0,1]=3
4  B8R1.7  CC(C)c1c[nH]cn1 Molport-028-747-057 [1,0,0,0,0,0|3,0,0]=4
5  B10R1.14  Cn1cnc(c1)C(O)CN Molport-022-148-102 [0,1,0,0,0,0|2,0,1]=4
6  B10R2.14  Cn1cnc(c1)C2CC2 Molport-035-942-750 [0,0,0,1,0,0|3,0,0]=4
7  B10R1.54  CC(N)Cc1cn(cn1)C Molport-029-722-978 [0,0,0,0,0,1|3,0,0]=4
8  B10R1.54  C[C@@H](N)Cc1cn(cn1)C Molport-004-776-038 [0,0,0,0,0,1|3,0,0]=4
9  B10R1.54  C[C@H](N)Cc1cn(cn1)C Molport-051-913-000 [0,0,0,0,0,1|3,0,0]=4
10  B9R1.7  CNCc1cn(cn1)C Molport-022-146-849 [1,1,0,0,0,0|1,0,1]=4
11  B9R1.7  COCc1cn(cn1)C Molport-038-267-020 [1,1,0,0,0,0|1,0,1]=4
12  B9R1.7  Cn1cnc(c1)CCN Molport-003-958-757 [1,1,0,0,0,0|2,0,0]=4
13  B9R1.7  Cn1cnc(c1)CCN Molport-004-946-867 [1,1,0,0,0,0|2,0,0]=4
14  B9R1.7  Cn1cnc(c1)CCN Molport-006-803-985 [1,1,0,0,0,0|2,0,0]=4
15  B9R1.7  Cn1cnc(c1)CCN Molport-051-776-635 [1,1,0,0,0,0|2,0,0]=4
16  B9R1.7  Cn1cnc(c1)CCO Molport-029-503-122 [1,1,0,0,0,0|1,0,1]=4
17  B9R1.21  CCn1cnc(c1)CN Molport-022-520-572 [1,1,0,0,0,0|2,0,0]=4
18  B9R1.21  CCn1cnc(c1)CN Molport-046-782-594 [1,1,0,0,0,0|2,0,0]=4
19  B9R1.21  CCn1cnc(c1)CO Molport-004-774-968 [1,1,0,0,0,0|1,0,1]=4
20  B9R1.23  Cc1nc(cn1C)CO Molport-029-279-080 [1,1,0,0,0,0|1,0,1]=4
21  B9R1.132  Cc1c(ncn1C)CN Molport-029-279-071 [1,1,0,0,0,0|2,0,0]=4
22  B9R1.132  Cc1c(ncn1C)CO Molport-029-001-479 [1,1,0,0,0,0|1,0,1]=4
23  B11R1.672  CC(=O)c1nc(n(c1C)C)C Molport-022-149-444 [0,2,0,0,0,0|2,0,0]=4