0  B11R1.182  CCOC1=CC(N)=CN=C1Br 23877 [1,0,0,0,0,0|3,0,0]=4
1  B11R1.280  COC1=C(S)C=CC(C#N)=C1 C91011 [1,0,0,0,0,0|1,1,1]=4
2  B11R1.280  O=CC1=CC(C=O)=C(Br)C=C1 P16880 [1,0,0,0,0,0|2,0,1]=4
3  B13R1.2900  CCOC1=CC(C=O)=C(Br)C=C1C AT10785 [0,1,0,0,0,0|1,0,0]=2
4  B13R1.2900  CCOC1=CC(CO)=C(Br)C=C1C AT10783 [0,1,0,0,0,0|1,0,2]=4
5  B13R2.57  C=CC1=NN=C2OCCOC2=C1 AT15325 [0,0,0,1,0,0|3,0,0]=4
6  B13R2.57  O=CC1=CN=C2CCCCC2=C1 F30565 [0,0,0,1,0,0|3,0,0]=4
7  B13R2.57  O=CC1=CN=C2OCCCC2=C1 D75294 [0,0,0,1,0,0|2,0,0]=3
8  B13R2.57  O=CC1=CN=C2OCCOC2=C1 D75313 [0,0,0,1,0,0|1,0,0]=2
9  B13R2.57  O=CC1=NC2=C(C=C1)CCCN2 67135 [0,0,0,1,0,0|3,0,0]=4
10  B13R2.57  O=CC1=NC=C2CCCCC2=C1 98444 [0,0,0,1,0,0|3,0,0]=4
11  B13R2.57  OCC1=CC2=C(C=N1)OCCO2 F53516 [0,0,0,1,0,0|1,0,2]=4
12  B13R2.57  OCC1=CN=C2OCCOC2=C1 D75295 [0,0,0,1,0,0|1,0,2]=4
13  B13R2.2121  CC1=CC2=C(C=C(C=O)C=C2)N1 AC8723 [0,0,0,1,0,0|2,0,1]=4
14  B10R1.30  CSC1=C(O)C=CC(F)=C1 C11142 [2,0,0,0,0,0|1,1,0]=4
15  B10R1.172  COC1=CN=CC(C=O)=N1 P12239 [2,0,0,0,0,0|2,0,0]=4
16  B10R1.172  [C-]#[N+]C1=CC=CC(OC)=C1 AC9601 [2,0,0,0,0,0|2,0,0]=4
17  B10R1.176  NC1=C(Br)C=CC(C=O)=C1 AT23717 [2,0,0,0,0,0|2,0,0]=4
18  B12R1.127  CC(C)OC1=C(F)C=CC(N)=C1 AT11980 [1,1,0,0,0,0|2,0,0]=4
19  B12R1.286  O=CC1=C(Cl)C=CC(CCO)=C1 D72239 [1,1,0,0,0,0|2,0,0]=4
20  B12R1.438  O=CC1=NC=CC(OC(F)F)=C1 D84772 [1,1,0,0,0,0|2,0,0]=4
21  B12R1.56  COC1=C(F)C=NC(C(=O)O)=C1 AT26887 [1,1,0,0,0,0|2,0,0]=4
22  B12R1.56  COC1=C(F)C=NC(C(C)=O)=C1 AT26885 [1,1,0,0,0,0|2,0,0]=4
23  B12R1.56  NCC1=C(F)C=CC(C(=O)O)=C1 AC6784 [1,1,0,0,0,0|2,0,0]=4
24  B12R1.78  COC1=CN=C(C=O)C=C1OC D85760 [1,1,0,0,0,0|1,0,0]=3
25  B12R1.654  COC1=C(Cl)C(C=O)=CC=C1O C11952 [1,1,0,0,0,0|0,0,0]=2
26  B14R1.2336  [2H]C([2H])([2H])OC1=C(F)C=CC(C=O)=C1 AT22865 [0,2,0,0,0,0|2,0,0]=4
27  B12R2.24  IC1=CN=C2OCCOC2=C1 D74359 [1,0,0,1,0,0|2,0,0]=4
28  B12R2.24  IC1=NC2=C(C=C1)OCCO2 D74357 [1,0,0,1,0,0|2,0,0]=4
29  B12R2.24  OC1=CN=C2OCCOC2=C1 D75296 [1,0,0,1,0,0|1,0,1]=4
30  B12R2.43  O=CC1=NC(C2CC2)=CC=C1 AT22124 [1,0,0,1,0,0|2,0,0]=4
31  B12R2.44  OCC1=CC2=C(C=C1)CCO2 Y10546 [1,0,0,1,0,0|0,0,2]=4
32  B14R2.3303  CC1(C)CC2=C(C=C(C=O)C=C2)O1 94698 [0,1,0,1,0,0|1,0,0]=3