0  B9R1.15  CC1=C(CBr)N=CC=C1 B016007 [1,0,0,0,0,0|2,0,1]=4
1  B9R1.15  CC1=C(CBr)N=CC=C1 B062311 [1,0,0,0,0,0|2,0,1]=4
2  B9R1.15  COC1=CC=CN=C1O B039509 [1,0,0,0,0,0|2,0,0]=3
3  B9R1.15  NC1=C(C=O)C=NC=C1 B050347 [1,0,0,0,0,0|3,0,0]=4
4  B9R1.15  NC1=NC=CC=C1C=O B049085 [1,0,0,0,0,0|3,0,0]=4
5  B11R1.37  COC1=C(CCl)C=C(Cl)C=C1 B050863 [0,1,0,0,0,0|1,0,1]=3
6  B11R1.37  COC1=CC=C(Br)C=C1C#N B005860 [0,1,0,0,0,0|1,0,1]=3
7  B11R1.37  COC1=CC=C(Br)C=C1C=O B005855 [0,1,0,0,0,0|1,0,0]=2
8  B11R1.53  NCC1=CC=CC=C1C(=O)O B049870 [0,1,0,0,0,0|3,0,0]=4
9  B11R1.53  O=C(O)C1=C(CBr)C=CC=C1 B019566 [0,1,0,0,0,0|3,0,0]=4
10  B11R2.1  NC1=NNC2=C1C=CC=C2 B047143 [0,0,0,1,0,0|3,0,0]=4
11  B10R1.4  CCOC1=C(N)N=CC=C1 B050894 [1,1,0,0,0,0|2,0,0]=4
12  B12R1.46  COC1=CC=C(Br)C=C1C(=O)O B025214 [0,2,0,0,0,0|1,0,0]=3
13  B12R1.78  CCC1=C(OC)C=CC(OC)=C1 B050664 [0,2,0,0,0,0|0,0,2]=4
14  B12R1.78  COC1=CC=C(C=O)C=C1CCl B006541 [0,2,0,0,0,0|1,0,1]=4
15  B12R1.112  CCOC1=CC=C(Br)C=C1C=O B005861 [0,2,0,0,0,0|1,0,0]=3
16  B12R1.112  CCOC1=CC=C(Cl)C=C1C=O B014154 [0,2,0,0,0,0|1,0,0]=3
17  B12R1.234  COC1=C(Br)C=C(Br)C=C1C#N B005932 [0,2,0,0,0,0|1,0,1]=4
18  B12R1.234  COC1=C(Br)C=C(Br)C=C1C=O B005927 [0,2,0,0,0,0|1,0,0]=3
19  B12R1.234  COC1=C(I)C=C(Br)C=C1C=O B005963 [0,2,0,0,0,0|1,0,0]=3
20  B12R1.121  COC1=CC=CC=C1OCCN B030091 [0,2,0,0,0,0|0,0,2]=4
21  B12R1.121  FCCOC1=C(CBr)C=CC=C1 B059294 [0,2,0,0,0,0|1,0,1]=4
22  B12R1.121  FCCOC1=C(CCl)C=CC=C1 B059293 [0,2,0,0,0,0|1,0,1]=4
23  B12R1.121  N#CCOC1=CC=CC=C1C=O B006029 [0,2,0,0,0,0|1,0,0]=3
24  B12R1.121  NCC1=C(OCCF)C=CC=C1 B059295 [0,2,0,0,0,0|1,0,1]=4
25  B12R1.121  O=CC1=C(OCCF)C=CC=C1 B059290 [0,2,0,0,0,0|1,0,0]=3
26  B12R1.121  OCC1=C(OCCF)C=CC=C1 B059292 [0,2,0,0,0,0|1,0,1]=4
27  B12R2.1  C=CN1C=NC2=CC=CC=C21 B048579 [0,1,0,1,0,0|1,0,1]=4
28  B12R2.18  CN1C(N)=NC2=C1C=CC=C2 B000495 [0,1,0,1,0,0|2,0,0]=4