0  B10R1.4  CCOc1ccccc1Br T20308 [1,0,0,0,0,0|3,0,0]=4
1  B10R1.4  CSCc1ccccc1O T33357 [1,0,0,0,0,0|2,0,0]=3
2  B10R1.4  O/N=C/c1ccccc1O T20346 [1,0,0,0,0,0|2,0,1]=4
3  B10R1.4  Oc1ccccc1CC=C T20472 [1,0,0,0,0,0|1,0,1]=3
4  B10R1.20  COc1ccccc1CN T1372 [1,0,0,0,0,0|0,0,0]=1
5  B10R1.20  COc1ccccc1OC T20326 [1,0,0,0,0,0|1,0,0]=2
6  B12R1.75  COc1ccccc1OC(C)=O T32015 [0,1,0,0,0,0|2,0,1]=4
7  B12R1.112  CCOc1ccc(N)cc1OC T34117 [0,1,0,0,0,0|2,0,0]=3
8  B12R1.121  COc1ccccc1C=CC=O T7452 [0,1,0,0,0,0|1,0,2]=4
9  B12R1.121  COc1ccccc1OCCN T1698 [0,1,0,0,0,0|0,0,0]=1
10  B12R1.169  NCCc1ccccc1CC=C T25047 [0,1,0,0,0,0|1,0,1]=3
11  B12R2.1  NCc1c[nH]c2ccccc12 T19373 [0,0,0,1,0,0|1,0,2]=4
12  B12R2.18  C[C@H]1[C@@H](O)Cc2ccncc12 TN3378 [0,0,0,1,0,0|3,0,0]=4
13  B12R2.24  CC1CCc2ccccc2N1 T20448 [0,0,0,1,0,0|3,0,0]=4
14  B12R2.24  O=C1CCc2ccccc2C1 T0660 [0,0,0,1,0,0|2,0,1]=4
15  B12R2.1081  O[C@H]1CCCC2=C1C=CC=C2 T19999 [0,0,0,1,0,0|3,0,0]=4
16  B9R1.8  CCOc1ccccc1 T19753 [2,0,0,0,0,0|2,0,0]=4
17  B9R1.8  CNCc1ccccc1 T8016 [2,0,0,0,0,0|2,0,0]=4
18  B9R1.8  NCCc1ccccc1 T2935 [2,0,0,0,0,0|0,0,0]=2
19  B9R1.8  NCCc1ccccc1 T7433 [2,0,0,0,0,0|0,0,0]=2
20  B9R1.8  NCCc1ccccn1 T22501 [2,0,0,0,0,0|1,0,0]=3
21  B9R1.8  O=CCc1ccccc1 TCS1857 [2,0,0,0,0,0|1,0,1]=4
22  B9R1.8  OCCc1ccccc1 T0011 [2,0,0,0,0,0|1,0,0]=3
23  B9R1.8  OCCc1ccccn1 T0658 [2,0,0,0,0,0|2,0,0]=4
24  B9R1.15  COc1ccccc1O T1301 [2,0,0,0,0,0|1,0,0]=3
25  B9R1.15  NCc1ccccc1O T41358 [2,0,0,0,0,0|0,0,0]=2
26  B9R1.15  OCc1ccccc1O T0311 [2,0,0,0,0,0|1,0,0]=3
27  B11R1.13  Cc1cccc(CC=C)c1O T29470 [1,1,0,0,0,0|1,0,1]=4
28  B11R1.13  Oc1cccc(CC=C)c1O T26596 [1,1,0,0,0,0|1,0,1]=4
29  B11R1.81  CCCc1ccc(C)cc1O T33238 [1,1,0,0,0,0|1,0,0]=3
30  B11R1.81  Oc1ccc(CC#N)c(O)c1 TN2721 [1,1,0,0,0,0|0,0,2]=4
31  B11R1.86  OC(=O)Cc1ccccc1O T5308 [1,1,0,0,0,0|1,0,1]=4
32  B11R1.182  Cc1ccc(O)c(CC=C)c1 T29333 [1,1,0,0,0,0|1,0,1]=4
33  B11R1.222  CCC(=O)c1ccccc1O T20371 [1,1,0,0,0,0|1,0,1]=4
34  B11R1.37  COc1ccc(O)cc1OC T3745 [1,1,0,0,0,0|1,0,0]=3
35  B11R1.53  COc1ccccc1C(O)=O T5874 [1,1,0,0,0,0|1,0,1]=4
36  B13R1.91  CNC(C)Cc1ccccc1OC T5035 [0,2,0,0,0,0|0,0,0]=2
37  B13R1.73  CCCOc1ccc(N)cc1OC T33210 [0,2,0,0,0,0|1,0,0]=3
38  B13R1.73  COCOc1ccc(N)cc1OC T30050 [0,2,0,0,0,0|2,0,0]=4
39  B11R2.20  C1SSCc2ccccc12 T12696 [1,0,0,1,0,0|2,0,0]=4
40  B11R2.1  O=C1CCc2ccccc12 T0564 [1,0,0,1,0,0|2,0,0]=4
41  B13R2.1  NCCc1c[nH]c2ccccc12 T0647 [0,1,0,1,0,0|1,0,1]=4
42  B9R1.33  Cc1[nH]cnc1CCN T50049 [1,0,0,0,1,0|2,0,0]=4
43  B9R1.33  Cn1cncc1CCN T4940 [1,0,0,0,1,0|2,0,0]=4