0  B11R1.266  COC1=CC=CC(C(C)N)=C1 HY-20143 [0,0,0,0,0,0|2,0,1]=3
1  B10R1.113  CC(N)C1=CC(O)=CC=C1 HY-70031 [1,0,0,0,0,0|2,0,1]=4
2  B10R1.113  CN1C=CCC(C(N)=O)=C1 HY-124313 [1,0,0,0,0,0|2,0,1]=4
3  B10R1.113  C[N+]1=CC(C(=O)[O-])=CC=C1 HY-N0414 [1,0,0,0,0,0|1,0,1]=3
4  B10R1.113  C[N+]1=CC(C(=O)[O-])=CC=C1 HY-N0414R [1,0,0,0,0,0|1,0,1]=3
5  B10R1.113  NC(=S)C1=CC(N)=CC=C1 HY-W128619 [1,0,0,0,0,0|2,1,0]=4
6  B10R1.113  O=C(O)C1=CC(Cl)=NC=N1 HY-W005983 [1,0,0,0,0,0|3,0,0]=4
7  B10R1.113  O=C(O)C1=CC=CC(Br)=C1 HY-Y0188 [1,0,0,0,0,0|1,0,0]=2
8  B12R1.279  CCOC1=CC(C(=O)O)=CC=C1 HY-W048341 [0,1,0,0,0,0|0,0,0]=1
9  B9R1.2  OCC1=CC=CC(O)=C1 HY-78446 [2,0,0,0,0,0|0,0,1]=3
10  B9R1.6  CC(=O)[13C]1=[13CH][13CH]=[13CH][13CH]=[13CH]1 HY-W782153 [2,0,0,0,0,0|1,0,0]=3
11  B9R1.6  [13CH3]C(=O)C1=CC=CC=C1 HY-Y0989S3 [2,0,0,0,0,0|1,0,0]=3
12  B11R1.21  O=C(O)C1=CC=C(Br)C(O)=C1 HY-W003445 [1,1,0,0,0,0|0,0,0]=2
13  B11R1.159  CC(=O)C1=CC=CC(O)=C1N HY-109690 [1,1,0,0,0,0|1,0,0]=3
14  B11R1.159  NC1=C(C(=O)O)C=CC=C1Cl HY-W002412 [1,1,0,0,0,0|1,0,0]=3
15  B11R1.159  O=C(O)C1=CC=CC(O)=C1O HY-Y0202R [1,1,0,0,0,0|0,0,0]=2
16  B11R1.267  COC1=C(O)C(C=O)=CC=C1 HY-Y1832 [1,1,0,0,0,0|0,0,0]=2
17  B11R1.280  COC1=C(O)C=CC(CN)=C1 HY-W097899 [1,1,0,0,0,0|1,0,1]=4
18  B11R1.280  N#CC1=CC(C=O)=CC=C1F HY-20138 [1,1,0,0,0,0|2,0,0]=4
19  B13R1.13  NC1=CC=C([N+](=O)[O-])C=C1C(=O)O HY-Y1681 [0,2,0,0,0,0|2,0,0]=4
20  B13R1.49  COC1=C(O)C=CC(C(O)CN)=C1 HY-W008794 [0,2,0,0,0,0|1,0,1]=4
21  B13R1.49  COC1=CC(C(O)CO)=CC=C1O HY-113323 [0,2,0,0,0,0|0,0,2]=4
22  B13R1.3801  NC1=C([N+](=O)[O-])C=CC=C1C(=O)O HY-Y1713 [0,2,0,0,0,0|2,0,0]=4
23  B13R1.2430  COC1=CC=C(C=O)C=C1C(=O)O HY-Z0451 [0,2,0,0,0,0|2,0,0]=4
24  B13R1.2430  COC1=CC=C(OC)C(C(=O)O)=C1 HY-W001936 [0,2,0,0,0,0|0,0,0]=2
25  B13R2.430  O=C(O)C1=CC=C2OCOC2=C1 HY-41404 [0,1,0,1,0,0|0,0,0]=2
26  B9R1.35  CC1=CC(C(=O)O)=NN1 HY-33009 [1,0,0,0,1,0|2,0,0]=4
27  B11R1.157  NC1=CC=CC(CC(=O)O)=C1 HY-W008015 [1,0,0,0,0,1|1,0,0]=3
28  B11R1.3  COC1=CC=C(B(O)O)C=C1 HY-W002177 [0,0,0,0,1,1|1,0,1]=4