0  B8R1.1  CCC1=CC=C(C)O1 HMDB0029728 [1,0,0,0,0,0|1,0,0]=2
1  B8R1.1  CCC1=CC=C(C)S1 HMDB0029733 [1,0,0,0,0,0|1,1,0]=3
2  B8R1.1  CCC1=CSC(C)=N1 HMDB0029731 [1,0,0,0,0,0|2,0,0]=3
3  B8R1.1  CCC1=NC(C)=CS1 HMDB0029730 [1,0,0,0,0,0|0,1,0]=2
4  B8R1.18  CC1=CC(C)=C(C)O1 HMDB0029721 [1,0,0,0,0,0|1,0,0]=2
5  B8R1.18  CC1OC(C)=CC1=O HMDB0032233 [1,0,0,0,0,0|2,0,1]=4
6  B8R1.18  CC1OC(C)C(C)=N1 HMDB0031199 [1,0,0,0,0,0|0,0,2]=3
7  B8R0.8  CCC/C=C(\C)C(C)=O HMDB0031590 [0,0,1,0,0,0|1,0,2]=4
8  B10R1.176  CCC1=CN=C(C)C(C)=N1 HMDB0029727 [0,0,0,0,0,1|1,0,0]=2
9  B7R0.5  CC/C=C(/C)C(O)=O HMDB0031560 [1,0,1,0,0,0|1,0,0]=3
10  B7R0.2  CCC(=O)OC(C)C HMDB0030056 [1,0,1,0,0,0|1,0,1]=4
11  B7R1.1  OCC1=CC=CO1 HMDB0013742 [2,0,0,0,0,0|2,0,0]=4
12  B9R1.7  CN1C=NC(CCN)=C1 HMDB0000898 [1,1,0,0,0,0|2,0,0]=4
13  B9R1.6  CC(=O)C1=NCCCC1 HMDB0030345 [0,0,1,1,0,0|0,0,2]=4
14  B9R1.6  OC(=O)C1=NCCCC1 HMDB0001084 [0,0,1,1,0,0|1,0,1]=4
15  B9R1.6  OC(=O)C1CCCC=N1 HMDB0012130 [0,0,1,1,0,0|1,0,1]=4
16  B9R1.69  CC1=NC(C)=C(C)N=C1 HMDB0031844 [0,0,1,1,0,0|1,0,1]=4
17  B9R0.24  CS/C(C)=N/OC(O)=NC HMDB0031804 [0,0,1,0,0,1|2,0,0]=4
18  B9R1.1  CCC1=CN=C(C)C=C1 HMDB0029729 [1,0,0,0,0,1|1,0,0]=3