0  B12R1.5  COC(=O)C1=CN=C(SC)N=C1 MO07902 [0,0,0,0,0,0|2,1,0]=3
1  B12R1.5  COC1=CC=C(C(=O)CBr)C=C1 CD00356 [0,0,0,0,0,0|2,0,0]=2
2  B12R1.5  COC1=CC=C(\C(N)=N\O)C=C1 RH01075 [0,0,0,0,0,0|3,0,0]=3
3  B11R1.3  CCC1=CC=C(C(=O)Cl)C=C1 BTB10319 [1,0,0,0,0,0|2,0,0]=3
4  B11R1.22  COC(=O)C1=CN=C(Cl)N=C1 MO07903 [1,0,0,0,0,0|3,0,0]=4
5  B11R1.22  O=C(CO)C1=CC=C(Br)C=C1 TL00596 [1,0,0,0,0,0|3,0,0]=4
6  B11R1.83  CCC1=CC=C(CNC)C=C1 MO00891 [1,0,0,0,0,0|2,0,1]=4
7  B11R1.83  CNCC1=CC=C(OC)C=C1 MO00889 [1,0,0,0,0,0|1,0,1]=3
8  B11R1.83  COC1=CC=C(N=C=S)C=C1 TL00326 [1,0,0,0,0,0|3,0,0]=4
9  B13R1.537  CN(C)C1=CC=C(C(=O)NN)C=C1 CD01774 [0,1,0,0,0,0|3,0,0]=4
10  B13R1.3088  COC(=O)C1=CC=C(OC)C(N)=C1 TL00302 [0,1,0,0,0,0|0,0,0]=1
11  B11R1.44  COC(=O)C1=CC=C(CCl)O1 BLT00257 [0,0,0,0,1,0|3,0,0]=4
12  B10R1.3  O=CC1=CC=C(CBr)C=C1 MO07312 [2,0,0,0,0,0|2,0,0]=4
13  B10R1.13  CC(=O)C1=CC=C(Cl)N=C1 MO00162 [2,0,0,0,0,0|2,0,0]=4
14  B10R1.13  CC1=NC=C(C(=O)O)N=C1 SB01107 [2,0,0,0,0,0|2,0,0]=4
15  B10R1.13  O=C(O)C1=NN=C(O)C=C1 BTB07063 [2,0,0,0,0,0|2,0,0]=4
16  B12R1.113  CCNC1=CC=C(C(=O)O)C=C1 BTB10315 [1,1,0,0,0,0|1,0,0]=3
17  B12R1.367  COC(=O)C1=CC(N)=C(N)C=C1 RDP00052 [1,1,0,0,0,0|1,0,0]=3
18  B12R1.367  COC(=O)C1=CC=C(C)C(Cl)=C1 TL00703 [1,1,0,0,0,0|0,0,0]=2
19  B12R1.367  COC(=O)C1=CN=C(N)C(Br)=C1 NP43794 [1,1,0,0,0,0|2,0,0]=4
20  B12R1.1703  CC1=CC(C)=C(C(=O)CBr)C=C1 CD00248 [1,1,0,0,0,0|2,0,0]=4
21  B12R1.71  COC1=CC=C(OCCN)C=C1 BTB10107 [1,1,0,0,0,0|2,0,0]=4
22  B14R1.65  CCCCC1=CC=C(C(=O)OC)C=C1 TL00831 [0,2,0,0,0,0|1,0,0]=3
23  B14R1.718  COC(=O)C1=CN=C(C(=O)OC)C=C1 RF02989 [0,2,0,0,0,0|1,0,0]=3
24  B14R1.628  CCOC(=O)C1=CC(N)=C(NC)C=C1 MO00109 [0,2,0,0,0,0|1,0,0]=3
25  B14R1.747  COC(=O)C1=CC=C([N+](=O)[O-])C(C)=C1 TL00715 [0,2,0,0,0,0|2,0,0]=4
26  B14R1.1864  COC(=O)C1=CC(C#N)=C(OC)C=C1 TL00306 [0,2,0,0,0,0|0,0,0]=2
27  B12R1.78  COC1=CC(OC)=C(C=O)C=C1 SB00910 [0,0,1,1,0,0|2,0,0]=4
28  B12R2.612  NC1=CC2=C(C=C1)C(=O)CC2 NRB01003 [1,0,0,1,0,0|2,0,0]=4
29  B12R2.612  O=C1COC2=C1C=CC(O)=C2 SEW02738 [1,0,0,1,0,0|2,0,0]=4
30  B14R2.966  COC(=O)C1=CC2=C(C=C1)NC=N2 MO00298 [0,1,0,1,0,0|1,0,1]=4
31  B14R2.966  COC(=O)C1=CC=C2SN=NC2=C1 KM10174 [0,1,0,1,0,0|1,1,0]=4
32  B14R2.966  O=C(CBr)C1=CC2=C(C=C1)OCO2 CC01605 [0,1,0,1,0,0|2,0,0]=4
33  B10R1.31  CSC1=CC=C(C(=O)O)S1 SEW03638 [1,0,0,0,1,0|1,1,0]=4
34  B10R1.14  COC(=O)C1=CN(C)C=N1 CC03622 [1,0,0,0,1,0|2,0,0]=4
35  B10R1.14  COC(=O)C1=NOC(C)=C1 CC10422 [1,0,0,0,1,0|2,0,0]=4
36  B12R1.435  COC(=O)C1=CC=CC(C#N)=C1 RJC00610 [0,0,0,0,1,1|2,0,0]=4
37  B12R1.435  COC(=O)C1=CC=CC(CN)=C1 MO07352 [0,0,0,0,1,1|2,0,0]=4
38  B12R1.435  COC1=CC(C(=O)C=O)=CC=C1 MAY00228 [0,0,0,0,1,1|2,0,0]=4