0  B13R2.4825  O=C1NC2=C(C=CC=C2Br)C1=O 100204 [0,0,0,0,0,0|1,1,1]=3
1  B12R2.18  C=C1C(=O)NC2=CC=CC=C12 18545 [1,0,0,0,0,0|2,0,0]=3
2  B12R2.18  CC1=C(C)C2=CC=CC=C2N1 16046 [1,0,0,0,0,0|3,0,0]=4
3  B12R2.18  CC1=CC2=CC=CC=C2C1O 16748 [1,0,0,0,0,0|3,0,0]=4
4  B12R2.18  CN1C(=O)CC2=CC=CC=C21 18631 [1,0,0,0,0,0|2,0,0]=3
5  B12R2.18  O=C1NC2=CC=CC=C2C1=O 20896 [1,0,0,0,0,0|1,0,1]=3
6  B12R2.1094  CC1=C2C(=O)C(=O)C2=CC=C1 16292 [0,0,0,0,1,0|2,0,1]=4
7  B14R2.8045  CC1=C2NC(=O)C=C(Cl)C2=CC=C1 9588 [0,0,0,0,0,1|3,0,0]=4
8  B14R2.8045  CC1=C2NC(=O)C=C(O)C2=CC=C1 9584 [0,0,0,0,0,1|2,0,0]=3
9  B14R2.8045  CC1=CC=CC2=C1OC(=O)C=C2O 20205 [0,0,0,0,0,1|3,0,0]=4
10  B14R2.28472  CC1=C2NC(=O)C(F)=CC2=CC=C1 101476 [0,0,0,0,0,1|3,0,0]=4
11  B14R2.28472  N1C(=O)C(F)=CC2=CC=CC(F)=C21 101349 [0,0,0,0,0,1|2,0,0]=3
12  B14R2.28472  O=C1NC2=C(Br)C=CC=C2C=C1F 100008 [0,0,0,0,0,1|2,1,0]=4
13  B14R2.28472  O=C1NC2=C(Br)C=CC=C2C=C1F 101477 [0,0,0,0,0,1|2,1,0]=4
14  B14R2.28472  O=C1NC2=C(Br)C=CC=C2C=C1F 101663 [0,0,0,0,0,1|2,1,0]=4
15  B14R2.28472  O=C1NC2=C(Cl)C=CC=C2C=C1F 101474 [0,0,0,0,0,1|2,1,0]=4
16  B11R1.159  O=C(O)C1=C(F)C(F)=CC=C1 102969 [1,0,1,0,0,0|2,0,0]=4
17  B11R1.159  O=C(O)C1=CC=CC(F)=C1O 101153 [1,0,1,0,0,0|2,0,0]=4
18  B11R1.36  NC(=O)C(N)C1=CC=CC=C1 19771 [1,0,1,0,0,0|2,0,0]=4
19  B11R1.157  CC(=O)NC1=CC=CC(Cl)=C1 17121 [1,0,1,0,0,0|1,1,0]=4
20  B11R1.157  O=C(O)CC1=CC=CC(F)=C1 102175 [1,0,1,0,0,0|2,0,0]=4
21  B11R1.86  CC(=O)NC1=CC=CC=C1Br 17116 [1,0,1,0,0,0|1,1,0]=4
22  B11R1.86  CC(=O)NC1=CC=CC=C1Cl 17122 [1,0,1,0,0,0|1,1,0]=4
23  B11R1.86  O=C(O)CC1=C(Br)C=CC=C1 102170 [1,0,1,0,0,0|1,1,0]=4
24  B11R1.86  O=C(O)CC1=C(O)C=CC=C1 20759 [1,0,1,0,0,0|2,0,0]=4
25  B11R1.86  O=C(O)CC1=CC=CC=C1Cl 102178 [1,0,1,0,0,0|1,1,0]=4
26  B11R1.86  O=C(O)CC1=CC=CC=C1O 19282 [1,0,1,0,0,0|2,0,0]=4
27  B11R2.10  CC1=NC2=CC=CC=C2N1 11720 [2,0,0,0,0,0|1,0,1]=4
28  B11R2.10  NC1=NC2=CC=CC=C2N1 500 [2,0,0,0,0,0|1,0,1]=4
29  B11R2.10  S=C1NC2=CC=CC=C2O1 18932 [2,0,0,0,0,0|1,1,0]=4
30  B11R2.10  SC1=NC2=C(C=CC=C2)N1 520 [2,0,0,0,0,0|0,1,1]=4
31  B13R1.470  O=C(\C=N\O)NC1=CC=CC=C1Br 100222 [0,1,1,0,0,0|0,1,1]=4
32  B13R2.3028  O=C1NC2=CC=C(F)C=C2C1=O 21030 [1,1,0,0,0,0|1,0,1]=4
33  B15R2.61372  CN1C(=O)C(F)=CC2=CC=CC(F)=C21 101338 [0,1,0,0,0,1|2,0,0]=4
34  B15R2.61372  CN1C(=O)C(F)=CC2=CC=CC(F)=C21 101466 [0,1,0,0,0,1|2,0,0]=4
35  B11R2.54  O=C1C(=O)C2=CC=CC=C12 16264 [1,0,0,0,1,0|1,0,1]=4
36  B11R2.54  O=C1C2=CC=CC=C2C1Cl 16693 [1,0,0,0,1,0|2,0,0]=4
37  B11R2.468  O=C1CC2=CC=CC(Br)=C12 16263 [1,0,0,0,1,0|1,1,0]=4
38  B11R2.468  O=C1CC2=CC=CC(Cl)=C12 16262 [1,0,0,0,1,0|1,1,0]=4
39  B11R2.468  O=C1CC2=CC=CC(F)=C12 16261 [1,0,0,0,1,0|1,0,0]=3
40  B13R2.328  O=C1C=C(O)C2=C(C=CC=C2)O1 20203 [1,0,0,0,0,1|2,0,0]=4
41  B13R2.328  O=C1C=C(O)C2=CC=CN=C2N1 19010 [1,0,0,0,0,1|2,0,0]=4
42  B13R2.328  O=C1NC(=O)C2=CC=CC=C2N1 20124 [1,0,0,0,0,1|1,0,1]=4