0  B10R1.18  C[C@@H](O)CC1=CC=CC=C1 HY-W017610 [0,0,0,0,0,0|1,0,0]=1
1  B11R1.20  CC(=O)N[13C]1=[13CH][13CH]=[13C](O)[13CH]=[13CH]1 HY-66005S3 [0,1,0,0,0,0|2,0,1]=4
2  B11R1.20  CC(N)CC1=CC=C(Br)C=C1 HY-W342779 [0,1,0,0,0,0|0,0,0]=1
3  B11R1.20  CC(N)CC1=CC=C(I)C=C1 HY-131556 [0,1,0,0,0,0|0,0,0]=1
4  B11R1.20  CC(N)CC1=CC=C(O)C=C1 HY-B1098B [0,1,0,0,0,0|0,0,0]=1
5  B11R1.40  CCC(N)CC1=CC=CC=C1 HY-116443 [0,1,0,0,0,0|0,0,0]=1
6  B11R1.86  CC(N)CC1=C(Br)C=CC=C1 HY-W721259 [0,1,0,0,0,0|0,0,0]=1
7  B11R1.157  CC(N)CC1=CC(Cl)=CC=C1 HY-W158945 [0,1,0,0,0,0|0,0,0]=1
8  B11R1.157  CC(N)CC1=CC=CC(Br)=C1 HY-135022 [0,1,0,0,0,0|0,0,0]=1
9  B11R1.157  C[C@H](N)CC1=CC(O)=CC=C1 HY-107354 [0,1,0,0,0,0|0,0,0]=1
10  B11R1.509  NS(=O)(=O)NC1=CC=CC=C1 HY-147353 [0,1,0,0,0,0|3,0,0]=4
11  B11R2.4  N[C@H]1C[C@@H]1C2=CC=CC=C2 HY-17447B [0,0,0,1,0,0|0,0,0]=1
12  B9R1.6  N[13C](=O)C1=[13CH][15N]=[13CH]C=C1 HY-B0150S1 [0,0,0,0,1,0|2,0,1]=4
13  B9R1.6  N[13C](=O)[13C]1=[13CH][13CH]=[13CH]N=[13CH]1 HY-B0150S2 [0,0,0,0,1,0|2,0,1]=4
14  B11R1.91  CC(=N)NCC1=CC=CC=C1 HY-W408607 [0,0,0,0,0,1|0,0,2]=3
15  B11R1.91  CC(C)NCC1=CC=CC=C1 HY-W420002 [0,0,0,0,0,1|1,0,0]=2
16  B11R1.91  O=C(O)[13CH2][13CH2]C1=CC=CC=C1 HY-Y1088S [0,0,0,0,0,1|2,0,1]=4
17  B8R1.2  NCC1=CC=CC=C1 HY-B1075AS [2,0,0,0,0,0|0,0,0]=2
18  B10R1.17  CNCCC1=CC=CC=C1 HY-34713 [1,1,0,0,0,0|0,0,0]=2
19  B10R1.28  [2H][13C]([2H])(O)C1=CC=CC=C1 HY-B0892S [0,1,0,0,1,0|2,0,0]=4
20  B12R1.226  N=C(N)NCC1=CC=CC(I)=C1 HY-129040AR [0,1,0,0,0,1|1,0,1]=4
21  B12R1.19  CC(N)CC1=CC(O)=C(O)C=C1 HY-W701743 [0,2,0,0,0,0|0,0,0]=2
22  B12R1.20  CC(N)C(=O)C1=CC=C(Cl)C=C1 HY-W173408 [0,2,0,0,0,0|0,0,1]=3
23  B12R1.49  CCC(N)CC1=CC=C(Cl)C=C1 HY-114859 [0,2,0,0,0,0|0,0,0]=2
24  B12R1.49  CNC(C)CC1=CC=C(Cl)C=C1 HY-129850 [0,2,0,0,0,0|0,0,0]=2
25  B12R1.118  CCC(CC1=CC=CC=C1)NC HY-W727031 [0,2,0,0,0,0|0,0,0]=2
26  B12R1.194  CNC(C)(C)CC1=CC=CC=C1 HY-W653809 [0,2,0,0,0,0|0,0,0]=2
27  B12R2.606  NC1CC2=C(C=C(I)C=C2)C1 HY-139378 [0,1,0,1,0,0|0,0,0]=2