0  B9R1.6  OB(O)C1=NC=CC=C1 570 [1,0,0,0,0,0|2,0,1]=4
1  B9R1.15  C#CC1=C(Cl)C=CC=C1 3106 [1,0,0,0,0,0|2,0,1]=4
2  B9R1.15  O=CC1=C(I)C=CC=C1 1830 [1,0,0,0,0,0|1,0,0]=2
3  B11R1.87  CC1=C(S(C)(=N)=O)C=CC=C1 4821 [0,1,0,0,0,0|3,0,0]=4
4  B11R1.87  CS(=N)(=O)C1=CC=CC=C1Br 4843 [0,1,0,0,0,0|3,0,0]=4
5  B11R1.87  CS(=N)(=O)C1=CC=CC=C1Cl 4840 [0,1,0,0,0,0|3,0,0]=4
6  B11R1.87  CS(=N)(=O)C1=CC=CC=C1F 4836 [0,1,0,0,0,0|3,0,0]=4
7  B11R1.87  CS(=N)(=O)C1=CC=CC=C1N 4829 [0,1,0,0,0,0|3,0,0]=4
8  B11R1.156  CC(=O)C1=C(C)C=CC=C1C 468 [0,1,0,0,0,0|2,0,0]=3
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  B11R1.222  CNC(=O)C1=C(S)C=CC=C1 2019 [0,1,0,0,0,0|1,1,0]=3
14  B9R1.41  O=C(O)C1=C(Br)N=CN1 3664 [0,0,0,0,1,0|3,0,0]=4
15  B10R1.13  NC(=O)C1=CC=C(N)N=C1 2364 [1,1,0,0,0,0|2,0,0]=4
16  B10R1.13  OB(O)C1=CC=C(Br)C=C1 1800 [1,1,0,0,0,0|1,0,1]=4
17  B10R1.15  O=C(NBr)C1=CC=CC=C1 4166 [1,1,0,0,0,0|1,0,0]=3
18  B10R1.28  CS(=N)(=O)C1=CC=CC=C1 4163 [1,1,0,0,0,0|2,0,0]=4
19  B12R1.127  O=C(O)CC1=C(O)C=CC(O)=C1 2881 [0,1,0,0,0,1|0,0,0]=2
20  B12R1.76  COC1=C(S(C)(=N)=O)C=CC=C1 4825 [0,2,0,0,0,0|2,0,0]=4
21  B12R1.894  NC1=CC=C(F)C(Cl)=C1C(=O)O 602 [0,2,0,0,0,0|1,0,0]=3
22  B12R1.3441  COC(=O)C1=C(O)C=CC=C1O 1473 [0,2,0,0,0,0|0,0,0]=2
23  B12R1.232  O=C(O)C1=CC(Br)=C(Cl)C=C1Cl 501 [0,2,0,0,0,0|1,0,0]=3
24  B12R1.1703  CNC(=O)C1=C(F)C=C(N)C=C1 3624 [0,2,0,0,0,0|2,0,0]=4
25  B12R1.1703  COC(=O)C1=CC=C(Cl)N=C1Cl 2867 [0,2,0,0,0,0|2,0,0]=4
26  B10R1.66  O=[N+]([O-])\C=C\C1=CC=CO1 759 [0,0,1,1,0,0|1,0,1]=4
27  B12R2.202  O=C1NC2=CC=CC(Br)=C2O1 1798 [0,0,0,1,0,1|2,0,0]=4