0  B10R1.30  CCC1=C(F)C=CC(F)=C1 105468 [1,0,0,0,0,0|3,0,0]=4
1  B10R1.30  COC1=CC(C)=CC=C1I 038666 [1,0,0,0,0,0|1,0,1]=3
2  B10R1.176  C(=O)C1=CC(Cl)=C(C)C=C1 208274 [1,0,0,0,0,0|3,0,0]=4
3  B12R1.56  COC1=C(C)C=CC(C(=O)Cl)=C1 020643 [0,1,0,0,0,0|2,0,0]=3
4  B12R1.56  COC1=C(Cl)C=CC(C(=O)O)=N1 210016 [0,1,0,0,0,0|3,0,0]=4
5  B12R1.78  COC1=C(OC)C=C(SC)C=C1 019351 [0,1,0,0,0,0|1,0,1]=3
6  B12R1.286  COC1=C(Cl)C=CC(N=C=O)=C1 104119 [0,1,0,0,0,0|2,0,1]=4
7  B12R1.286  COC1=C(Cl)C=CC(N=C=S)=C1 104118 [0,1,0,0,0,0|2,0,1]=4
8  B12R1.286  COC1=C(F)C=CC(N=C=S)=C1 035063 [0,1,0,0,0,0|2,0,1]=4
9  B12R1.449  COC1=C(C)C=C(O)C(C=O)=C1 025080 [0,1,0,0,0,0|2,0,0]=3
10  B12R1.453  CC(C)C1=C(Cl)C=CC(C=O)=C1 069719 [0,1,0,0,0,0|3,0,0]=4
11  B9R1.15  C#CC1=CC=CC=C1O 222906 [2,0,0,0,0,0|1,0,1]=4
12  B9R1.15  CCC1=C(F)C=CC=C1 037698 [2,0,0,0,0,0|2,0,0]=4
13  B9R1.69  CC1=C(S)C=CC(Br)=C1 037981 [2,0,0,0,0,0|1,1,0]=4
14  B9R1.69  CC1=C(S)C=CC(F)=C1 023130 [2,0,0,0,0,0|1,1,0]=4
15  B11R1.8  COC1=C(Br)C(Br)=CC(N)=C1 061628 [1,1,0,0,0,0|2,0,0]=4
16  B11R1.8  COC1=C(Cl)C(Br)=CC(I)=C1 061631 [1,1,0,0,0,0|2,0,0]=4
17  B11R1.8  COC1=CC(C)=CC(Br)=C1N 038669 [1,1,0,0,0,0|1,0,1]=4
18  B11R1.72  COC1=C(N)C=CC(Br)=C1C 038821 [1,1,0,0,0,0|2,0,0]=4
19  B11R1.72  COC1=C(O)C(F)=CC=C1F 038322 [1,1,0,0,0,0|2,0,0]=4
20  B11R1.182  CCOC1=C(I)C=CC(Br)=C1 038699 [1,1,0,0,0,0|2,0,0]=4
21  B11R1.277  COC1=C(I)C=C(Cl)C(Br)=C1 037540 [1,1,0,0,0,0|2,0,0]=4
22  B11R1.277  COC1=C(I)C=C(F)C(Br)=C1 094765 [1,1,0,0,0,0|2,0,0]=4
23  B11R1.277  COC1=CC(Br)=C(C)C=C1Cl 038677 [1,1,0,0,0,0|2,0,0]=4
24  B11R1.277  COC1=CC(Br)=C(C)C=C1I 038679 [1,1,0,0,0,0|2,0,0]=4
25  B11R1.9  COC1=CC(S)=CC(OC)=C1 038588 [1,1,0,0,0,0|1,0,1]=4
26  B11R1.9  [C-]#[N+]C1=CC(Cl)=CC(OC)=C1 024393 [1,1,0,0,0,0|1,0,1]=4
27  B11R1.189  CCSC1=CC(OC)=CC=C1 094566 [1,1,0,0,0,0|0,0,2]=4
28  B11R1.266  COC1=CC(S(=O)[O-])=CC=C1 045961 [1,1,0,0,0,0|2,0,0]=4
29  B11R1.266  CO[N+]1=CC(C(=O)O)=CC=C1 181676 [1,1,0,0,0,0|2,0,0]=4
30  B11R1.266  CO[N+]1=CC(C(N)=O)=CC=C1 181646 [1,1,0,0,0,0|2,0,0]=4
31  B11R1.267  COC1=CC=CC(C=O)=C1F 049660 [1,1,0,0,0,0|1,0,0]=3
32  B11R1.21  CC1=C(C)C=C(C(N)=S)C=C1 097861 [1,1,0,0,0,0|2,0,0]=4
33  B11R1.21  CC1=C(I)C=CC(C(=O)Cl)=C1 103960 [1,1,0,0,0,0|2,0,0]=4
34  B13R1.651  COC1=C(Cl)C=C(Cl)C(C(=O)O)=C1 069722 [0,2,0,0,0,0|2,0,0]=4
35  B13R1.2200  COC1=C(OC)C=C(CO)C(Br)=C1 319997 [0,2,0,0,0,0|1,0,1]=4
36  B13R1.433  CCC1=CC(OC)=C(O)C(C=O)=C1 025078 [0,2,0,0,0,0|0,0,2]=4
37  B13R2.449  O\N=C\C1=CC2=C(C=C1)OCC2 094017 [0,1,0,1,0,0|2,0,0]=4