0  B9R1.8  c1ccc(cc1)CNN CM14002 [0,0,0,0,0,0|4,0,0]=4
1  B9R1.8  c1ccc(cc1)CNO CM10002 [0,0,0,0,0,0|4,0,0]=4
2  B8R1.2  COc1cccnc1 CM10357 [1,0,0,0,0,0|2,0,0]=3
3  B10R1.1  c1cc(ccc1CCBr)Cl CM13503 [0,1,0,0,0,0|3,0,0]=4
4  B10R1.1  c1cc(ccc1CCBr)F CM13509 [0,1,0,0,0,0|3,0,0]=4
5  B10R1.1  c1cc(ccc1CCCl)Cl CM13502 [0,1,0,0,0,0|3,0,0]=4
6  B10R1.1  c1cc(ccc1CCO)Cl CM13495 [0,1,0,0,0,0|3,0,0]=4
7  B10R1.1  c1cc(ccc1CCO)F CM13508 [0,1,0,0,0,0|3,0,0]=4
8  B10R1.1  c1cc(ccc1CCO)O CM10966 [0,1,0,0,0,0|3,0,0]=4
9  B10R1.4  CCOc1cnccc1N CM10330 [0,1,0,0,0,0|2,0,0]=3
10  B10R1.4  c1ccc(c(c1)CCO)Br CM13494 [0,1,0,0,0,0|3,0,0]=4
11  B10R1.10  c1cc(cc(c1)F)CCN CM13556 [0,1,0,0,0,0|3,0,0]=4
12  B10R1.10  c1cc(cc(c1)F)CCO CM13507 [0,1,0,0,0,0|3,0,0]=4
13  B10R1.10  c1cc(cc(c1)N)CCO CM10010 [0,1,0,0,0,0|3,0,0]=4
14  B10R1.15  CCC(C)c1ccccc1 CM12120 [0,1,0,0,0,0|2,0,0]=3
15  B10R1.15  COC(=O)c1cccnc1 CM10959 [0,1,0,0,0,0|2,0,1]=4
16  B10R2.7  c1ccc2c(c1)CNC2 CM10320 [0,0,0,1,0,0|3,0,0]=4
17  B7R1.3  c1cc(cnc1)F CM13853 [2,0,0,0,0,0|2,0,0]=4
18  B7R1.3  c1ccnc(c1)Cl CM13847 [2,0,0,0,0,0|2,0,0]=4
19  B9R1.1  CCc1ccc(cc1)F CM10050 [1,1,0,0,0,0|2,0,0]=4
20  B9R1.1  CCc1ccc(cn1)Br CM10444 [1,1,0,0,0,0|1,0,0]=3
21  B9R1.1  CCc1ncc(cn1)Br CM10686 [1,1,0,0,0,0|2,0,0]=4
22  B9R1.1  COc1ccc(nc1)Br CM10454 [1,1,0,0,0,0|2,0,0]=4
23  B9R1.2  CCc1cccc(c1)Br CM12087 [1,1,0,0,0,0|2,0,0]=4
24  B9R1.2  CCc1cccc(c1)N CM11452 [1,1,0,0,0,0|2,0,0]=4
25  B9R1.2  COc1cc(ccn1)Br CM10671 [1,1,0,0,0,0|2,0,0]=4
26  B9R1.2  CSc1cccc(n1)Br CM10114 [1,1,0,0,0,0|2,0,0]=4
27  B9R1.15  CCc1c(cccn1)Br CM10670 [1,1,0,0,0,0|1,0,0]=3
28  B9R1.15  COc1c(nccn1)N CM10653 [1,1,0,0,0,0|1,0,0]=3
29  B9R1.15  COc1cccnc1Br CM14120 [1,1,0,0,0,0|2,0,0]=4
30  B9R1.15  COc1cccnc1N CM10903 [1,1,0,0,0,0|2,0,0]=4
31  B9R1.15  COc1cnccc1N CM10329 [1,1,0,0,0,0|2,0,0]=4
32  B11R1.20  CC(C)Cc1ccc(cc1)Br CM12109 [0,2,0,0,0,0|2,0,0]=4
33  B11R1.22  COC(=O)c1cnc(cn1)O CM14417 [0,2,0,0,0,0|1,0,1]=4
34  B11R1.222  CCC(C)c1ccccc1N CM11342 [0,2,0,0,0,0|2,0,0]=4
35  B11R1.23  COC(=O)c1cncc(n1)Br CM10424 [0,2,0,0,0,0|1,0,1]=4
36  B11R1.23  COC(=O)c1cncc(n1)Cl CM10425 [0,2,0,0,0,0|1,0,1]=4
37  B11R1.12  B(CC)(CC)c1cccnc1 CM10967 [0,2,0,0,0,0|2,0,0]=4
38  B11R1.16  CCOC(=O)c1cccnc1 CM10029 [0,2,0,0,0,0|1,0,1]=4
39  B11R2.34  c1c(cnc(n1)C2CC2)Br CM10450 [0,1,0,1,0,0|2,0,0]=4
40  B11R2.34  c1cc(ncc1C2CC2)Br CM10127 [0,1,0,1,0,0|1,0,0]=3
41  B11R2.20  c1cncc2c1NCCC2 CM10439 [0,1,0,1,0,0|1,0,0]=3
42  B11R2.35  c1c(cncc1Br)C2CC2 CM10133 [0,1,0,1,0,0|1,0,0]=3
43  B11R2.35  c1cc(nc(c1)Br)C2CC2 CM10128 [0,1,0,1,0,0|1,0,0]=3
44  B7R1.1  c1c[nH]nc1CCl CM10174 [1,0,0,0,1,0|2,0,0]=4