0  B7R1.3  CC1=CC=CC=C1 HMDB0034168 [0,0,0,0,0,0|2,0,0]=2
1  B7R1.3  NC1=CC=CC=C1 HMDB0003012 [0,0,0,0,0,0|1,0,0]=1
2  B7R1.3  OC1=CC=CC=C1 HMDB0000228 [0,0,0,0,0,0|2,0,0]=2
3  B8R1.2  COC1=CC=CC=C1 HMDB0033895 [0,1,0,0,0,0|2,0,0]=3
4  B8R1.2  NCC1=CC=CC=C1 HMDB0033871 [0,1,0,0,0,0|1,0,0]=2
5  B8R1.3  CC1=CC=C(O)C=C1 HMDB0001858 [0,1,0,0,0,0|2,0,0]=3
6  B8R1.3  NC1=CC=C(O)C=C1 HMDB0001169 [0,1,0,0,0,0|1,0,0]=2
7  B8R1.3  O=C1C=CC(=O)C=C1 HMDB0003364 [0,1,0,0,0,0|2,0,0]=3
8  B8R1.3  OC1=CC=C(O)C=C1 HMDB0002434 [0,1,0,0,0,0|2,0,0]=3
9  B8R1.4  CC1=CC=CC(O)=C1 HMDB0002048 [0,1,0,0,0,0|2,0,0]=3
10  B8R1.4  NC1=CC=NC(=O)N1 HMDB0000630 [0,1,0,0,0,0|1,0,0]=2
11  B8R1.4  O=C1C=CNC(=O)N1 HMDB0000300 [0,1,0,0,0,0|2,0,1]=4
12  B8R1.5  CC1=CC=CC=C1O HMDB0002055 [0,1,0,0,0,0|2,0,0]=3
13  B8R1.5  N=C1C=CNC=C1O HMDB0060741 [0,1,0,0,0,0|0,0,2]=3
14  B8R1.5  OC1=CC=CC=C1O HMDB0000957 [0,1,0,0,0,0|2,0,0]=3
15  B6R1.2  CC1=CC=CO1 HMDB0013749 [0,0,0,0,1,0|2,0,0]=3
16  B6R1.2  CC1=CNN=C1 HMDB0015344 [0,0,0,0,1,0|2,0,0]=3
17  B7R1.1  O=CC1=CC=CO1 HMDB0032914 [0,1,0,0,1,0|2,0,0]=4
18  B7R1.1  OCC1=CC=CO1 HMDB0013742 [0,1,0,0,1,0|2,0,0]=4
19  B7R1.1  OCC1=CNN=C1 HMDB0060768 [0,1,0,0,1,0|2,0,0]=4
20  B7R1.2  CC1=CC=C(C)O1 HMDB0033182 [0,1,0,0,1,0|2,0,0]=4
21  B7R1.4  CC1=CSC=C1C HMDB0032980 [0,1,0,0,1,0|2,0,0]=4
22  B9R1.1  CCC1=CC=C(O)C=C1 HMDB0029306 [0,2,0,0,0,0|2,0,0]=4
23  B9R1.1  O=CC1=CC=C(O)C=C1 HMDB0011718 [0,2,0,0,0,0|2,0,0]=4
24  B9R1.6  CC(N)C1=CC=CC=C1 HMDB0002017 [0,2,0,0,0,0|1,0,0]=3
25  B9R1.6  NC(=O)C1=CC=CN=C1 HMDB0001406 [0,2,0,0,0,0|2,0,0]=4
26  B9R1.6  O=C(O)C1=CC=CC=C1 HMDB0001870 [0,2,0,0,0,0|2,0,0]=4
27  B9R1.6  O=C(O)C1=CC=NC=C1 HMDB0060665 [0,2,0,0,0,0|1,0,0]=3
28  B9R1.8  NCCC1=CC=CC=C1 HMDB0012275 [0,2,0,0,0,0|1,0,0]=3
29  B9R1.15  COC1=C(O)C=CC=C1 HMDB0001398 [0,2,0,0,0,0|2,0,0]=4
30  B9R1.69  CC1=CC(C)=C(C)C=C1 HMDB0013733 [0,2,0,0,0,0|2,0,0]=4
31  B9R1.69  CC1=CC=C(O)C(O)=C1 HMDB0000873 [0,2,0,0,0,0|2,0,0]=4
32  B9R1.69  NC1=C(F)C=NC(=O)N1 HMDB0015231 [0,2,0,0,0,0|1,0,0]=3
33  B9R1.69  OC1=C(Cl)C=CC(Cl)=C1 HMDB0041800 [0,2,0,0,0,0|2,0,0]=4
34  B9R1.69  OC1=CC=C(Cl)C=C1Cl HMDB0004811 [0,2,0,0,0,0|2,0,0]=4
35  B9R1.3  CC1=CC=CC(C)=C1N HMDB0060677 [0,2,0,0,0,0|1,0,0]=3
36  B9R1.3  OC1=CC=CC(O)=C1O HMDB0013674 [0,2,0,0,0,0|2,0,0]=4
37  B5R1.1  C1=CNC=N1 HMDB0001525 [1,0,0,0,1,0|1,0,0]=3
38  B5R1.1  C1=COC=C1 HMDB0013785 [1,0,0,0,1,0|1,0,0]=3