0  B11R1.166  O=C(O)C1=CNC(=S)NC1=O HY-W052750 [0,0,0,0,0,0|2,1,1]=4
1  B10R1.13  O=C(O)C1=CC=C(Br)C=C1 HY-78700 [1,0,0,0,0,0|1,0,0]=2
2  B10R1.13  O=C(O)C1=CC=C(O)N=C1 HY-W001996R [1,0,0,0,0,0|1,0,0]=2
3  B10R1.13  O=C(O)[13C]1=[13CH][13CH]=[13C](O)[13CH]=[13CH]1 HY-Y0264S [1,0,0,0,0,0|0,0,0]=1
4  B10R1.13  O=[13C](O)C1=CC=C(O)C=C1 HY-Y0264S2 [1,0,0,0,0,0|0,0,0]=1
5  B10R1.61  CC(=O)C1=CC=CC=C1C HY-W012658 [1,0,0,0,0,0|2,0,0]=3
6  B10R1.61  CC(=O)C1=CC=CC=C1N HY-I0501 [1,0,0,0,0,0|2,0,0]=3
7  B10R1.61  CC1=C([13C](=O)O)C=CC=C1 HY-41494S1 [1,0,0,0,0,0|1,0,0]=2
8  B10R1.61  O=C(O)C1=NC=CC=C1S HY-128923 [1,0,0,0,0,0|1,1,0]=3
9  B12R1.893  O=C(O)C1=C(F)C(Cl)=C(F)C=C1 HY-W015082 [0,1,0,0,0,0|2,0,0]=3
10  B9R1.1  OCC1=CC=C(O)C=C1 HY-Y0892R [2,0,0,0,0,0|0,0,1]=3
11  B9R1.6  CC(=O)[13C]1=[13CH][13CH]=[13CH][13CH]=[13CH]1 HY-W782153 [2,0,0,0,0,0|1,0,0]=3
12  B9R1.6  [13CH3]C(=O)C1=CC=CC=C1 HY-Y0989S3 [2,0,0,0,0,0|1,0,0]=3
13  B9R1.15  CC1=C([13CH]=O)C=CC=C1 HY-Y0442S [2,0,0,0,0,0|1,0,0]=3
14  B9R1.69  CC1=CC(O)=C(O)C=C1 HY-W012814R [2,0,0,0,0,0|1,0,0]=3
15  B11R1.3  COC1=CC=C(B(O)O)C=C1 HY-W002177 [1,1,0,0,0,0|1,0,1]=4
16  B11R1.21  O=C(O)C1=CC=C(Br)C(O)=C1 HY-W003445 [1,1,0,0,0,0|1,0,0]=3
17  B11R1.21  O=[N+]([O-])C1=CC=C(O)C(Cl)=C1 HY-Y0510 [1,1,0,0,0,0|1,0,1]=4
18  B11R1.22  N=C(NO)C1=CC=C(N)C=C1 HY-135200 [1,1,0,0,0,0|2,0,0]=4
19  B11R1.22  NC1=CC=C(C(=O)O[K])C=C1 HY-B1008A [1,1,0,0,0,0|1,0,0]=3
20  B11R1.53  CCC1=CC=CC=C1C(N)=O HY-W412047 [1,1,0,0,0,0|2,0,0]=4
21  B11R1.53  CNC1=C(C(=O)O)C=CC=C1 HY-W040705 [1,1,0,0,0,0|1,0,0]=3
22  B11R1.87  NC1=CC=CC=C1S(=O)(=O)O HY-W015302 [1,1,0,0,0,0|2,0,0]=4
23  B11R1.156  CC1=C(C(=O)O)C(O)=CC=C1 HY-W002751 [1,1,0,0,0,0|0,0,0]=2
24  B11R1.156  NC1=CC=CC(Cl)=C1C(=O)O HY-Y1132 [1,1,0,0,0,0|1,0,0]=3
25  B11R1.159  CC(=O)C1=CC=CC(O)=C1N HY-109690 [1,1,0,0,0,0|2,0,0]=4
26  B11R1.159  NC1=C(C(=O)O)C=CC=C1Cl HY-W002412 [1,1,0,0,0,0|1,0,0]=3
27  B11R1.159  O=C(O)C1=CC=CC(O)=C1O HY-Y0202R [1,1,0,0,0,0|0,0,0]=2
28  B13R1.315  COC1=C(C(C)=O)C(O)=CC(O)=C1 HY-N1667 [0,2,0,0,0,0|1,0,0]=3
29  B13R1.120  CC(=O)C1=CC=C(C(=O)O)C(C)=C1 HY-W076700 [0,2,0,0,0,0|1,0,1]=4
30  B13R1.120  O=C(O)C1=CC=C([N+](=O)[O-])C(O)=C1 HY-69341 [0,2,0,0,0,0|1,0,1]=4
31  B11R2.36  OC1=CC=C2OCOC2=C1 HY-N1417 [1,0,0,1,0,0|2,0,0]=4
32  B11R2.1  O=C1COC2=C1C=CC=C2 HY-W001165 [1,0,0,1,0,0|1,0,0]=3
33  B13R2.3683  O=C1C=CC2=CC(O)=CC=C2O1 HY-N6656 [0,0,0,1,0,1|2,0,0]=4
34  B11R1.20  [13CH3][13C](=O)[15NH]C1=CC=C(O)C=C1 HY-66005S4 [1,0,0,0,0,1|1,0,0]=3
35  B11R1.86  CC(=O)NC1=C(O)C=CC=C1 HY-W015600R [1,0,0,0,0,1|1,0,0]=3