0  B6R0.6  C\C=C\C=C\C=O HY-W068035 [1,0,0,0,0,0|0,0,0]=1
1  B8R0.5  CCOC(=O)CC(=O)O HY-Y1031R [0,1,0,0,0,0|1,0,2]=4
2  B8R0.28  CC(=O)CCC=C(C)C HY-W010435R [0,1,0,0,0,0|1,0,2]=4
3  B8R1.4  O=C1C=C[15NH][13C](=O)[15NH]1 HY-I0960S [0,0,0,1,0,0|3,0,0]=4
4  B8R1.7  CC(=O)C1=CC=CN1 HY-W012956R [0,0,0,1,0,0|2,0,0]=3
5  B8R1.7  CC(=O)C1=NSC=C1 HY-W458364 [0,0,0,1,0,0|3,0,0]=4
6  B8R1.7  O=C(O)C1=CC=CN1 HY-W001963R [0,0,0,1,0,0|1,0,0]=2
7  B7R0.3  C\C=C\CC(=O)OC HY-W127411 [1,1,0,0,0,0|0,0,1]=3
8  B7R0.5  CCCC(=O)C(=O)O HY-113098R [1,1,0,0,0,0|0,0,2]=4
9  B7R1.3  Br[13C]1=[13CH][13CH]=[13CH][13CH]=[13CH]1 HY-W780150 [1,0,0,1,0,0|2,0,0]=4
10  B7R1.3  O=C1C=CC=CN1 HY-Y0191R [1,0,0,1,0,0|1,0,0]=3
11  B7R1.3  OC1=CC=CN=C1 HY-Y1129R [1,0,0,1,0,0|2,0,0]=4
12  B7R1.1  O=CC1=CC=CN1 HY-77817R [1,0,0,1,0,0|1,0,0]=3
13  B9R1.6  CC(=O)C1=CN=CC=N1 HY-W007692R [0,1,0,1,0,0|2,0,0]=4
14  B9R1.6  NC(=O)C1=CC=CC=C1 HY-Z0283R [0,1,0,1,0,0|1,0,1]=4
15  B9R1.6  NC(=O)C1=NC=CC=C1 HY-101020R [0,1,0,1,0,0|1,0,1]=4
16  B9R1.35  CC1=CC(C(=O)O)=NN1 HY-33009R [0,1,0,1,0,0|2,0,0]=4
17  B9R1.35  O=C(O)C1=CC=C(Cl)S1 HY-76835R [0,1,0,1,0,0|1,0,0]=3
18  B9R1.69  CC1=C(Br)C=NC(=O)N1 HY-W326740 [0,1,0,1,0,0|2,0,0]=4
19  B9R1.69  CC1=CC(O)=CC=C1O HY-W012817R [0,1,0,1,0,0|1,0,0]=3