0  B7R1.3  c1cnc(cn1)N 10007093 [0,0,0,0,0,0|3,0,0]=3
1  B7R1.3  c1cnccc1N 18511 [0,0,0,0,0,0|2,0,0]=2
2  B8R1.2  c1ccc(cc1)N=O 21009 [0,1,0,0,0,0|0,0,1]=2
3  B8R1.2  c1cnc(nc1)C#N 10007121 [0,1,0,0,0,0|3,0,0]=4
4  B8R1.2  c1cnc(nc1)CCl 10007122 [0,1,0,0,0,0|3,0,0]=4
5  B8R1.2  c1cnc(nc1)CN 10007106 [0,1,0,0,0,0|3,0,0]=4
6  B8R1.2  c1cnc(nc1)CO 10007112 [0,1,0,0,0,0|2,0,0]=3
7  B8R1.2  c1cncnc1CN 10007124 [0,1,0,0,0,0|3,0,0]=4
8  B8R1.2  c1cncnc1CO 10007111 [0,1,0,0,0,0|2,0,0]=3
9  B8R1.4  c1c[nH]c(=O)[nH]c1=S 16952 [0,1,0,0,0,0|2,0,1]=4
10  B6R1.2  Cc1c[nH]nc1 17851 [0,0,0,0,1,0|3,0,0]=4
11  B9R1.6  c1cc(cnc1)C(=O)N 11127 [0,2,0,0,0,0|1,0,1]=4
12  B9R1.6  c1ccc(cc1)C(=N)N 20651 [0,2,0,0,0,0|1,0,0]=3
13  B9R1.6  c1ccnc(c1)C(=S)N 13043 [0,2,0,0,0,0|1,1,0]=4
14  B9R1.6  c1cnc(nc1)C(=O)O 10007123 [0,2,0,0,0,0|2,0,0]=4
15  B9R1.6  c1cnccc1C(=S)N 13056 [0,2,0,0,0,0|1,1,0]=4
16  B9R1.6  c1cncnc1C(=O)O 10010564 [0,2,0,0,0,0|2,0,0]=4
17  B9R1.8  c1ccc(cc1)CCBr 20087 [0,2,0,0,0,0|1,0,0]=3
18  B9R1.8  c1ccc(cc1)CCN 14206 [0,2,0,0,0,0|1,0,0]=3
19  B9R1.15  COc1ccccc1O 70430 [0,2,0,0,0,0|0,0,0]=2
20  B9R1.69  c1c(c(c[nH]c1=O)Cl)O 16525 [0,2,0,0,0,0|1,0,0]=3
21  B9R1.3  c1cc(c(c(c1)O)O)O 20347 [0,2,0,0,0,0|0,0,0]=2
22  B9R1.34  c1c(nc(nc1O)N)N 81260 [0,2,0,0,0,0|2,0,0]=4