0  B10R1.113  CN(N)C1=CC=CC(Br)=C1 4054 [0,0,0,0,0,0|4,0,0]=4
1  B9R1.6  OB(O)C1=NC=CC=C1 570 [1,0,0,0,0,0|2,0,1]=4
2  B11R1.23  N#CC(O)C1=CC=CC(O)=C1 3125 [0,1,0,0,0,0|1,0,1]=3
3  B11R1.74  O=C1C=C(C(=O)O)NC(=S)N1 1380 [0,1,0,0,0,0|2,0,1]=4
4  B11R1.155  CC1=CC=CC(S(C)(=N)=O)=C1 4820 [0,1,0,0,0,0|3,0,0]=4
5  B11R1.155  CS(=N)(=O)C1=CC=CC(Br)=C1 4842 [0,1,0,0,0,0|3,0,0]=4
6  B11R1.155  CS(=N)(=O)C1=CC=CC(Cl)=C1 4839 [0,1,0,0,0,0|3,0,0]=4
7  B11R1.155  CS(=N)(=O)C1=CC=CC(F)=C1 4835 [0,1,0,0,0,0|3,0,0]=4
8  B11R1.155  CS(=N)(=O)C1=CC=CC(N)=C1 4828 [0,1,0,0,0,0|3,0,0]=4
9  B11R1.159  CC(=O)C1=C(C)C(C)=CC=C1 1792 [0,1,0,0,0,0|2,0,0]=3
10  B11R1.159  O=[N+]([O-])C1=CC=CC(O)=C1O 475 [0,1,0,0,0,0|1,0,1]=3
11  B11R1.167  CC(=O)C1=C(N)C=CC(Br)=C1 445 [0,1,0,0,0,0|2,0,0]=3
12  B11R1.167  CC1=NC(C(=O)O)=C(N)C=N1 334 [0,1,0,0,0,0|3,0,0]=4
13  B9R1.41  O=C(O)C1=C(Br)N=CN1 3664 [0,0,0,0,1,0|3,0,0]=4
14  B10R1.172  C(=O)C1=CC=CC(C=O)=N1 645 [1,1,0,0,0,0|1,0,1]=4
15  B10R1.176  CCC1=CC=C(F)C(O)=C1 4520 [1,1,0,0,0,0|1,0,1]=4
16  B10R1.13  NC(=O)C1=CC=C(N)N=C1 2364 [1,1,0,0,0,0|2,0,0]=4
17  B10R1.13  OB(O)C1=CC=C(Br)C=C1 1800 [1,1,0,0,0,0|1,0,1]=4
18  B10R1.15  O=C(NBr)C1=CC=CC=C1 4166 [1,1,0,0,0,0|1,0,0]=3
19  B10R1.28  CS(=N)(=O)C1=CC=CC=C1 4163 [1,1,0,0,0,0|2,0,0]=4
20  B10R1.31  O=CC1=CC=C(C(=O)O)O1 795 [0,1,0,0,1,0|1,0,1]=4
21  B10R1.31  O=CC1=CC=C(C(=O)O)S1 796 [0,1,0,0,1,0|1,0,1]=4
22  B12R1.127  O=C(O)CC1=C(O)C=CC(O)=C1 2881 [0,1,0,0,0,1|0,0,0]=2
23  B12R1.48  COC1=CC=C(C(C)=O)C=C1Cl 2703 [0,2,0,0,0,0|2,0,0]=4
24  B12R1.56  N#CC1=CC(C(=O)O)=CC=C1Cl 4188 [0,2,0,0,0,0|1,0,0]=3
25  B12R1.232  O=C(O)C1=CC(Br)=C(Cl)C=C1Cl 501 [0,2,0,0,0,0|1,0,0]=3
26  B12R1.367  COC(=O)C1=CC(=O)C(O)=CO1 798 [0,2,0,0,0,0|1,0,1]=4
27  B12R1.358  COC(=O)C1=CC(Cl)=NC(Cl)=C1 613 [0,2,0,0,0,0|2,0,0]=4
28  B12R1.436  COC1=CC=CC(S(C)(=N)=O)=C1 4824 [0,2,0,0,0,0|2,0,0]=4
29  B12R1.894  NC1=CC=C(F)C(Cl)=C1C(=O)O 602 [0,2,0,0,0,0|1,0,0]=3
30  B10R1.66  O=[N+]([O-])\C=C\C1=CC=CO1 759 [0,0,1,1,0,0|1,0,1]=4
31  B12R2.202  O=C1NC2=CC=CC(Br)=C2O1 1798 [0,0,0,1,0,1|1,0,0]=3
32  B12R2.606  O=C1CC2=CC=C(Br)C=C2N1 2583 [0,0,0,1,0,1|2,0,0]=4