0  B10R1.113  CC(N)C1=CC(O)=CC=C1 HY-70031 [0,0,0,0,0,0|3,0,1]=4
1  B10R1.113  CN1C=CCC(C(N)=O)=C1 HY-124313 [0,0,0,0,0,0|0,0,2]=2
2  B10R1.113  C[N+]1=CC(C(=O)[O-])=CC=C1 HY-N0414 [0,0,0,0,0,0|1,0,0]=1
3  B10R1.113  C[N+]1=CC(C(=O)[O-])=CC=C1 HY-N0414R [0,0,0,0,0,0|1,0,0]=1
4  B10R1.113  NC(=S)C1=CC(N)=CC=C1 HY-W128619 [0,0,0,0,0,0|2,1,0]=3
5  B10R1.113  O=C(O)C1=CC=CC(Br)=C1 HY-Y0188 [0,0,0,0,0,0|3,0,0]=3
6  B9R1.6  CC(=O)[13C]1=[13CH][13CH]=[13CH][13CH]=[13CH]1 HY-W782153 [1,0,0,0,0,0|2,0,0]=3
7  B9R1.6  N=C(N)C1=CN=CC=C1 HY-W002264 [1,0,0,0,0,0|1,0,1]=3
8  B9R1.6  NC(=O)C1=NC=CN=C1 HY-B0271R [1,0,0,0,0,0|1,0,1]=3
9  B9R1.6  NC(=S)C1=NC=CN=C1 HY-W129661 [1,0,0,0,0,0|1,1,1]=4
10  B9R1.6  [13CH3]C(=O)C1=CC=CC=C1 HY-Y0989S3 [1,0,0,0,0,0|2,0,0]=3
11  B11R1.21  O=C(O)C1=CC=C(Br)C(O)=C1 HY-W003445 [0,1,0,0,0,0|3,0,0]=4
12  B11R1.159  CC(=O)C1=CC=CC(O)=C1N HY-109690 [0,1,0,0,0,0|3,0,0]=4
13  B11R1.159  NC1=C(C(=O)O)C=CC=C1Cl HY-W002412 [0,1,0,0,0,0|3,0,0]=4
14  B11R1.159  O=C(O)C1=CC=CC(O)=C1O HY-Y0202R [0,1,0,0,0,0|3,0,0]=4
15  B11R1.266  COC1=CC=CC(C(C)N)=C1 HY-20143 [0,1,0,0,0,0|2,0,1]=4
16  B11R1.157  NC1=CC=CC(CC(=O)O)=C1 HY-W008015 [0,0,0,0,0,1|3,0,0]=4
17  B10R1.13  O=C(O)C1=CC=C(Br)C=C1 HY-78700 [1,1,0,0,0,0|2,0,0]=4
18  B10R1.13  O=C(O)C1=CC=C(O)N=C1 HY-W001996R [1,1,0,0,0,0|1,0,1]=4
19  B10R1.13  O=C(O)[13C]1=[13CH][13CH]=[13C](O)[13CH]=[13CH]1 HY-Y0264S [1,1,0,0,0,0|2,0,0]=4
20  B10R1.13  O=[13C](O)C1=CC=C(O)C=C1 HY-Y0264S2 [1,1,0,0,0,0|2,0,0]=4
21  B10R1.15  CNC(=O)C1=NC=CC=C1 HY-Z4481 [1,1,0,0,0,0|2,0,0]=4
22  B10R1.15  COC(=O)C1=CC=CN=C1 HY-B1695 [1,1,0,0,0,0|1,0,1]=4
23  B10R1.15  NNC(=S)C1=CC=CC=C1 HY-129943 [1,1,0,0,0,0|1,1,0]=4
24  B10R1.15  O=C(CO)C1=CC=CC=C1 HY-W002198 [1,1,0,0,0,0|2,0,0]=4
25  B10R1.61  CC(=O)C1=CC=CC=C1C HY-W012658 [1,1,0,0,0,0|2,0,0]=4
26  B10R1.61  CC(=O)C1=CC=CC=C1N HY-I0501 [1,1,0,0,0,0|2,0,0]=4
27  B10R1.61  CC1=C([13C](=O)O)C=CC=C1 HY-41494S1 [1,1,0,0,0,0|2,0,0]=4
28  B12R1.279  CCOC1=CC(C(=O)O)=CC=C1 HY-W048341 [0,2,0,0,0,0|2,0,0]=4
29  B8R1.7  CC(=O)C1=CC=CN1 HY-W012956 [1,0,0,0,1,0|1,0,1]=4
30  B8R1.7  O=C(O)C1=CC=CN1 HY-W001963 [1,0,0,0,1,0|1,0,1]=4