0  B11R2.36  Cc1ccc2c(c1)ccs2 TS01153 [1,0,0,0,0,0|3,0,0]=4
1  B11R2.36  c1c[nH]c2c1cnc(=O)[nH]2 TS05977 [1,0,0,0,0,0|3,0,0]=4
2  B11R2.36  c1cc(nc2c1scc2)Cl TS89295 [1,0,0,0,0,0|2,0,1]=4
3  B11R2.36  c1cc2c(ccs2)cc1Br TS71466 [1,0,0,0,0,0|3,0,0]=4
4  B11R2.36  c1cc2c(ccs2)cc1Br TS93234 [1,0,0,0,0,0|3,0,0]=4
5  B11R2.36  c1cc2c(ccs2)cc1Cl TS71511 [1,0,0,0,0,0|3,0,0]=4
6  B11R2.36  c1cc2c(ccs2)cc1N TS60421 [1,0,0,0,0,0|3,0,0]=4
7  B11R2.36  c1cnn2c1[nH]c(=O)cc2 TS90114 [1,0,0,0,0,0|3,0,0]=4
8  B11R2.36  c1csc2c1cc(cn2)N TS86798 [1,0,0,0,0,0|2,0,1]=4
9  B13R2.369  CC1C(=O)Nc2ccccc2N1 TS32792 [0,0,0,0,0,1|2,0,1]=4
10  B13R2.369  c1cc2c([nH]c(=O)c(=O)[nH]2)nc1 TS42547 [0,0,0,0,0,1|1,0,0]=2
11  B13R2.369  c1ccc2c(c1)[nH]c(=O)c(n2)N TS91753 [0,0,0,0,0,1|2,0,1]=4
12  B10R1.27  c1cscc1CC(=O)NN TS10699 [1,0,1,0,0,0|2,0,0]=4
13  B10R1.66  CC(=O)C=Cc1cccs1 TS41166 [1,0,1,0,0,0|2,0,0]=4
14  B10R1.66  c1cc(sc1)C=CC(=O)Cl TS45576 [1,0,1,0,0,0|2,0,0]=4
15  B10R1.66  c1cc(sc1)C=CC(=O)O TS41387 [1,0,1,0,0,0|2,0,0]=4
16  B10R1.66  c1cscc1C=CC(=O)Cl TS45575 [1,0,1,0,0,0|2,0,0]=4
17  B10R1.66  c1cscc1C=CC(=O)O TS41388 [1,0,1,0,0,0|2,0,0]=4
18  B10R2.7  c1cc2c(ccs2)nc1 TS89324 [2,0,0,0,0,0|1,0,1]=4
19  B10R2.7  c1ccc2c(c1)ccs2 TS55756 [2,0,0,0,0,0|2,0,0]=4
20  B12R2.44  c1cc2c(ccs2)cc1C=O TS42474 [1,1,0,0,0,0|2,0,0]=4
21  B12R2.246  c1csc2c1[nH]c(=O)[nH]c2=O TS87051 [1,1,0,0,0,0|2,0,0]=4
22  B14R2.1128  c1ccc2c(c1)cc(c(=O)[nH]2)C=O TS09408 [0,1,0,0,0,1|2,0,0]=4
23  B14R2.8239  c1c(cnc2c1[nH]c(=O)c(=O)[nH]2)Br TS55663 [0,1,0,0,0,1|1,0,0]=3
24  B12R2.252  c1csc2c1[nH]c(c2)C(=O)Cl TS48799 [0,0,1,1,0,0|2,0,0]=4
25  B12R2.252  c1csc2c1[nH]c(c2)C(=O)O TS12382 [0,0,1,1,0,0|2,0,0]=4
26  B12R2.18  c1cc2c(nc1)NC(=O)C2=O TS00460 [0,0,1,1,0,0|2,0,0]=4
27  B12R2.18  c1ccc2c(c1)C(=O)C(=O)N2 TS47172 [0,0,1,1,0,0|2,0,0]=4
28  B10R1.23  c1cc(oc1)C(=O)C(=O)N TS06348 [0,0,1,0,1,0|0,1,0]=3
29  B10R1.23  c1cc(oc1)C(=O)C(=O)O TS02176 [0,0,1,0,1,0|1,1,0]=4
30  B10R1.23  c1cc(sc1)C(=O)C(=O)O TS10665 [0,0,1,0,1,0|1,0,0]=3
31  B10R1.23  c1cocc1C(=O)C(=O)O TS06407 [0,0,1,0,1,0|1,1,0]=4
32  B10R1.149  COC(=O)c1c(ccs1)N TS08569 [0,0,1,0,1,0|2,0,0]=4
33  B10R1.149  COC(=O)c1ccsc1N TS08550 [0,0,1,0,1,0|2,0,0]=4
34  B10R2.2  c1csc2c1NC(=O)C2 TS60409 [1,0,0,0,1,0|0,0,1]=3
35  B12R2.24  c1cc(=O)[nH]c2c1cncc2 TS01996 [1,0,0,0,0,1|2,0,0]=4
36  B12R2.24  c1ccc2c(c1)NCC(=O)N2 TS32785 [1,0,0,0,0,1|1,0,1]=4
37  B14R2.738  c1ccc2c(c1)NC(=O)CC(=O)N2 TS46076 [0,0,0,0,0,2|1,0,0]=3