0  B9R1.69  CC1=CC(O)=C(O)C=C1 HY-W012814R [0,0,0,0,0,0|1,0,1]=2
1  B8R1.3  FC1=CN=C(Br)C=C1 HY-32748 [1,0,0,0,0,0|2,0,1]=4
2  B8R1.3  NC1=NC=C(F)C=C1 HY-Y0107 [1,0,0,0,0,0|2,0,1]=4
3  B8R1.4  CC1=CC(Br)=NC=C1 HY-W007579 [1,0,0,0,0,0|3,0,0]=4
4  B8R1.5  NC1=C(O)C=NC=C1 HY-W008188 [1,0,0,0,0,0|3,0,0]=4
5  B8R1.5  OC1=NC=CC=C1Br HY-W003045 [1,0,0,0,0,0|1,0,2]=4
6  B10R1.30  COC1=C(Cl)C=CC(Br)=C1 HY-W012416 [0,1,0,0,0,0|3,0,0]=4
7  B10R1.30  COC1=C(O)C=CC(O)=C1 HY-W013675 [0,1,0,0,0,0|2,0,1]=4
8  B10R1.30  O=CC1=CC(F)=CNC1=O HY-44532 [0,1,0,0,0,0|1,0,1]=3
9  B10R1.30  OCC1=CC(O)=CC=C1O HY-W248907 [0,1,0,0,0,0|2,0,1]=4
10  B10R1.119  [2H]C1=C([2H])C(=O)NNC1=O HY-59354S [0,1,0,0,0,0|3,0,0]=4
11  B10R1.176  CCC1=CC=C(O)C(O)=C1 HY-W265757 [0,1,0,0,0,0|1,0,1]=3
12  B10R1.176  COC1=CC=C(O)C(N)=C1 HY-W001213 [0,1,0,0,0,0|2,0,1]=4
13  B7R1.3  OC1=CC=NC=C1 HY-W007690 [2,0,0,0,0,0|2,0,0]=4
14  B9R1.1  OCC1=CC=C(O)C=C1 HY-Y0892R [1,1,0,0,0,0|1,0,1]=4
15  B9R1.2  OCC1=CC=CC(O)=C1 HY-78446 [1,1,0,0,0,0|1,0,0]=3
16  B9R1.34  CC1=CC(O)=CC(=O)O1 HY-Y1634 [1,1,0,0,0,0|2,0,0]=4
17  B9R1.34  CC1=CC(O)=CC(O)=C1 HY-W015715 [1,1,0,0,0,0|1,0,0]=3
18  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
19  B9R1.15  CC1=C([13CH]=O)C=CC=C1 HY-Y0442S [1,1,0,0,0,0|2,0,0]=4
20  B9R1.22  CC1=NC(C)=C(C=O)N1 HY-65067 [0,1,0,0,1,0|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  B11R1.280  COC1=C(O)C=CC(CN)=C1 HY-W097899 [0,2,0,0,0,0|1,0,1]=4
23  B11R1.192  NCCC1=CC=C(O)C(O)=C1 HY-B0451AR [0,2,0,0,0,0|1,0,1]=4
24  B11R1.192  NCC[13C]1=[13CH][13C](O)=[13C](O)[13CH]=[13CH]1 HY-B0451AS1 [0,2,0,0,0,0|1,0,1]=4
25  B11R1.192  N[13CH2]CC1=CC=C(O)C(O)=C1 HY-B0451AS5 [0,2,0,0,0,0|1,0,1]=4
26  B11R1.192  O=CCC1=CC=C(O)C(O)=C1 HY-121252 [0,2,0,0,0,0|1,0,1]=4