0  B11R1.22  CC1=NC=C(\C(C)=N\O)C=C1 BTB07185 [0,0,0,0,0,0|2,0,2]=4
1  B12R1.9  C=CS(=O)(=O)C1=CC=C(C)C=C1 KM00150 [0,1,0,0,0,0|3,0,0]=4
2  B9R1.1  CSC1=CC=C(Br)C=C1 BTB04532 [2,0,0,0,0,0|2,0,0]=4
3  B11R1.20  CC(=O)NC1=CC=C(Br)C=C1 KM05555 [1,1,0,0,0,0|2,0,0]=4
4  B11R1.20  CC(=O)NC1=CC=C(F)C=C1 DP01919 [1,1,0,0,0,0|2,0,0]=4
5  B11R1.20  CC(=O)NC1=CC=C(I)C=C1 RH00230 [1,1,0,0,0,0|2,0,0]=4
6  B11R1.20  CC1=CC=C(CC(=O)O)C=C1 MB00106 [1,1,0,0,0,0|0,0,0]=2
7  B11R1.20  CC1=CC=C(CC(N)=S)C=C1 DP01389 [1,1,0,0,0,0|0,1,0]=3
8  B11R1.20  CC1=CC=C(NC(N)=O)C=C1 JA00151 [1,1,0,0,0,0|1,0,0]=3
9  B11R1.20  NC(=O)NC1=CC=C(Cl)C=C1 S04036 [1,1,0,0,0,0|2,0,0]=4
10  B11R1.20  NC(=S)CC1=CC=C(Cl)C=C1 DP01382 [1,1,0,0,0,0|1,1,0]=4
11  B11R1.20  O=C(O)CC1=CC=C(Br)C=C1 TL00410 [1,1,0,0,0,0|1,0,0]=3
12  B11R1.20  O=C(O)CC1=CC=C(F)C=C1 RH01845 [1,1,0,0,0,0|1,0,0]=3
13  B11R1.3  CCC1=CC=C(C(=O)O)C=C1 BTB09873 [1,1,0,0,0,0|1,0,1]=4
14  B11R1.3  CNC1=CC=C(C(=O)O)C=C1 JFD03586 [1,1,0,0,0,0|1,0,1]=4
15  B11R1.3  O=C(O)C1=CC=C(CO)C=C1 BTB13819 [1,1,0,0,0,0|1,0,1]=4
16  B11R1.19  CC1=CC=C(S(=O)(=O)O)C=C1 BTB10192 [1,1,0,0,0,0|2,0,0]=4
17  B11R1.19  CC1=CC=C(S(C)(=O)=O)C=C1 KM00234 [1,1,0,0,0,0|1,0,0]=3
18  B11R1.19  CS(=O)(=O)C1=CC=C(Cl)C=C1 KM00170 [1,1,0,0,0,0|2,0,0]=4
19  B11R1.36  CC(=O)N(C)C1=CC=CN=C1 RH01105 [1,1,0,0,0,0|2,0,0]=4
20  B11R1.36  CN(C(N)=S)C1=CC=CC=C1 TL00838 [1,1,0,0,0,0|1,1,0]=4
21  B11R1.36  N[C@@H](C(=O)O)C1=CC=CC=C1 JFD03710 [1,1,0,0,0,0|1,0,0]=3
22  B11R1.36  O=C(O)C(O)C1=CC=CC=C1 JFD03933 [1,1,0,0,0,0|1,0,0]=3
23  B13R1.132  NC(CC(=O)O)C1=CC=C(Cl)C=C1 KM08205 [0,2,0,0,0,0|2,0,0]=4
24  B13R1.163  CC(=O)N(C)C1=C(Cl)C=C(Cl)C=C1 TL00916 [0,2,0,0,0,0|2,0,0]=4
25  B13R1.163  CC(=O)N(C)C1=CC=C(F)C=C1F TL00933 [0,2,0,0,0,0|2,0,0]=4
26  B13R2.3028  CC1=CC2=C(C=C1)NC(=O)C2=O JA00002 [0,0,0,1,0,1|1,0,1]=4
27  B13R2.3028  CC1=CC2=C(C=C1)SC(=O)C2=O KM09178 [0,0,0,1,0,1|1,0,1]=4