0  B13R2.328  O=c1[nH]c(=O)c2ccccc2o1 T0258 [0,0,0,0,0,0|3,0,1]=4
1  B13R2.328  Oc1cc(=O)oc2ccccc12 PDK0015 [0,0,0,0,0,0|4,0,0]=4
2  B13R2.328  Oc1cc2ccccc2c(O)c1 TD0092 [0,0,0,0,0,0|4,0,0]=4
3  B13R2.328  Oc1nc(O)c2ccccc2n1 T8020 [0,0,0,0,0,0|2,0,0]=2
4  B12R2.24  Clc1ccc2ccccc2c1 T20317 [1,0,0,0,0,0|3,0,0]=4
5  B12R2.24  O=c1ccc2ccccc2o1 T0775 [1,0,0,0,0,0|3,0,0]=4
6  B12R2.24  Oc1ccc2ccccc2c1 T0671 [1,0,0,0,0,0|3,0,0]=4
7  B12R2.1081  Brc1cccc2ccccc12 T29891 [1,0,0,0,0,0|3,0,0]=4
8  B12R2.1081  Fc1cccc2ccccc12 T0541 [1,0,0,0,0,0|3,0,0]=4
9  B12R2.1081  Oc1cccc2ccccc12 T10023 [1,0,0,0,0,0|3,0,0]=4
10  B12R2.1081  Oc1ccnc2ccccc12 T4272 [1,0,0,0,0,0|2,0,0]=3
11  B12R2.1081  Oc1ncnc2ccccc12 TMO2713 [1,0,0,0,0,0|1,0,0]=2
12  B12R2.1081  Sc1cccc2ccccc12 T20404 [1,0,0,0,0,0|3,0,0]=4
13  B14R2.7724  Nc1n[n+]([O-])c2ccccc2[n+]1[O-] T4434 [0,1,0,0,0,0|2,0,1]=4
14  B14R2.8045  Cc1nc2c(O)cccc2c(=O)[nH]1 T6912 [0,1,0,0,0,0|2,0,1]=4
15  B14R2.8235  Nc1nc(O)c2[nH]c(=O)cnc2n1 T13969 [0,1,0,0,0,0|3,0,0]=4
16  B14R2.29365  Nc1nc(N)c2ccc(Br)cc2n1 T3693 [0,1,0,0,0,0|0,0,0]=1
17  B12R2.18  O=C1Nc2ccccc2C1=O T6862 [0,0,0,0,1,0|2,0,1]=4
18  B12R2.246  Nc1nc(O)nc2nc[nH]c12 T19382 [0,0,0,0,1,0|3,0,0]=4
19  B12R2.246  Nc1nc(S)c2nc[nH]c2n1 T3089 [0,0,0,0,1,0|3,0,0]=4
20  B12R2.246  Nc1nc2[nH]ccc2c(=O)[nH]1 T5445 [0,0,0,0,1,0|2,0,1]=4
21  B12R2.246  Nc1nc2[nH]ccn2c(=O)n1 T19148 [0,0,0,0,1,0|3,0,0]=4
22  B12R2.2028  S=C1NC(=S)c2ccccc12 T25525 [0,0,0,0,1,0|2,0,1]=4
23  B11R1.91  O=C(N)\C=C\C1=CC=CC=C1 T13669 [1,0,1,0,0,0|2,0,0]=4
24  B11R1.91  O=C(N)\C=C\C1=CC=CC=C1 T20050 [1,0,1,0,0,0|2,0,0]=4
25  B13R1.348  NC(N)=N/C(N)=N/c1ccccc1 T7135 [0,1,1,0,0,0|0,0,0]=2
26  B13R2.369  Nc1cc2ccccc2cc1N T18881 [1,1,0,0,0,0|2,0,0]=4
27  B13R2.3683  Cc1ccc2nc(C)ccc2c1 T37784 [1,1,0,0,0,0|2,0,0]=4
28  B13R2.342  ClC1=CCC=C2C(=O)N=CN=C12 T8619 [1,1,0,0,0,0|1,0,1]=4
29  B13R2.342  Oc1cccc2c(O)nccc12 T7042 [1,1,0,0,0,0|2,0,0]=4
30  B13R2.342  Oc1cccc2c1nccc2Cl T9160 [1,1,0,0,0,0|2,0,0]=4
31  B13R2.1613  NNc1nncc2ccccc12 T1613 [1,1,0,0,0,0|2,0,0]=4
32  B13R2.45  N/C=C1\Cc2ccccc2C1=O T31576 [0,1,0,0,1,0|2,0,0]=4
33  B11R2.1  Nn1nnc2ccccc12 T5953 [1,0,0,0,1,0|2,0,0]=4
34  B11R2.10  Nc1nc2ccccc2s1 T1347 [1,0,0,0,1,0|1,0,0]=3
35  B11R2.10  Sc1nc2ccccc2s1 T19856 [1,0,0,0,1,0|2,0,0]=4
36  B11R2.10  [S-]c1nc2ccccc2[nH]1 T21238 [1,0,0,0,1,0|1,0,1]=4
37  B11R2.36  Nc1ncc2[nH]cnc2n1 T19836 [1,0,0,0,1,0|2,0,0]=4
38  B11R2.106  Nc1ncnc2[nH]cnc12 T0064 [1,0,0,0,1,0|2,0,0]=4
39  B11R2.106  Nc1ncnc2[nH]cnc12 T6369 [1,0,0,0,1,0|2,0,0]=4
40  B11R2.106  Nc1ncnc2nc[nH]c12 T5081 [1,0,0,0,1,0|2,0,0]=4
41  B11R2.106  Nc1ncnc2nc[nH]c12 T6225 [1,0,0,0,1,0|2,0,0]=4