0  B9R1.69  CC1=CC(Cl)=NN=C1Cl HY-W015388 [0,0,0,0,0,0|3,0,1]=4
1  B9R1.69  CC1=CC(O)=C(O)C=C1 HY-W012814R [0,0,0,0,0,0|2,0,1]=3
2  B8R1.3  FC1=CN=C(Br)C=C1 HY-32748 [1,0,0,0,0,0|1,1,1]=4
3  B8R1.3  NC1=NC=C(F)C=C1 HY-Y0107 [1,0,0,0,0,0|1,1,1]=4
4  B8R1.4  ClC1=CN=CC(Cl)=N1 HY-W010260 [1,0,0,0,0,0|2,0,1]=4
5  B8R1.5  NC1=C(O)C=NC=C1 HY-W008188 [1,0,0,0,0,0|3,0,0]=4
6  B8R1.5  OC1=NC=CC=C1Br HY-W003045 [1,0,0,0,0,0|1,0,2]=4
7  B10R1.22  NC1=CC(Cl)=CC(F)=C1I HY-Z8324 [0,1,0,0,0,0|3,0,0]=4
8  B10R1.30  COC1=C(Cl)C=CC(Br)=C1 HY-W012416 [0,1,0,0,0,0|2,1,0]=4
9  B10R1.30  COC1=C(O)C=CC(O)=C1 HY-W013675 [0,1,0,0,0,0|2,0,1]=4
10  B10R1.30  O=CC1=CC(F)=CNC1=O HY-44532 [0,1,0,0,0,0|0,1,1]=3
11  B10R1.30  OCC1=CC(O)=CC=C1O HY-W248907 [0,1,0,0,0,0|2,0,1]=4
12  B10R1.119  OC1=C(Cl)C(Cl)=NC=C1Cl HY-W105233 [0,1,0,0,0,0|2,0,1]=4
13  B10R1.119  [2H]C1=C([2H])C(=O)NNC1=O HY-59354S [0,1,0,0,0,0|3,0,0]=4
14  B10R1.176  CCC1=CC=C(O)C(O)=C1 HY-W265757 [0,1,0,0,0,0|2,0,1]=4
15  B7R1.3  ClC1=CC=NC=C1 HY-Y0178 [2,0,0,0,0,0|2,0,0]=4
16  B7R1.3  OC1=CC=NC=C1 HY-W007690 [2,0,0,0,0,0|2,0,0]=4
17  B9R1.2  OCC1=CC=CC(O)=C1 HY-78446 [1,1,0,0,0,0|2,0,0]=4
18  B9R1.34  CC1=CC(O)=CC(O)=C1 HY-W015715 [1,1,0,0,0,0|2,0,0]=4
19  B9R1.34  O[13C]1=[13CH][13C](O)=[13CH][13C](O)=[13CH]1 HY-W777964 [1,1,0,0,0,0|2,0,0]=4
20  B9R1.15  CC1=C([13CH]=O)C=CC=C1 HY-Y0442S [1,1,0,0,0,0|2,0,0]=4
21  B11R1.8  COC1=CC(=O)C=C(C)C1=O HY-W473763 [0,2,0,0,0,0|2,0,0]=4
22  B11R1.37  COC1=CC(Cl)=CC=C1C#N HY-Z1086 [0,2,0,0,0,0|2,0,0]=4