0  B5R0.1  CNCC(O)=O S0121 [1,0,0,0,0,0|2,0,1]=4
1  B5R0.2  BrCCCC=C B0624 [1,0,0,0,0,0|1,0,2]=4
2  B5R0.3  OCC(Cl)CO C0752 [1,0,0,0,0,0|3,0,0]=4
3  B7R0.2  COC(=O)C[C@@H](C)O H0102 [0,1,0,0,0,0|1,0,2]=4
4  B7R0.10  C(C(C(CS)O)O)S D0323 [0,1,0,0,0,0|2,0,0]=3
5  B4R0.1  C#CC(O)C B0123 [2,0,0,0,0,0|0,0,2]=4
6  B4R0.2  CC\C=N\O P0059 [2,0,0,0,0,0|1,0,1]=4
7  B6R0.2  CC(O)CC([O-])=O H0080 [1,1,0,0,0,0|1,0,1]=4
8  B6R0.4  OC(CCCN)=O G0043 [1,1,0,0,0,0|1,0,1]=4
9  B6R0.6  CCCC/C=C/I I0047 [1,1,0,0,0,0|0,0,2]=4
10  B8R1.5  BrC1CCCCC1=O B0249 [0,1,0,1,0,0|0,0,2]=4
11  B8R1.5  O[C@@H]1CSSC[C@H]1O D0277 [0,1,0,1,0,0|2,0,0]=4
12  B8R1.19  CC1(C)CCCC1=O D0333 [0,1,0,1,0,0|0,0,2]=4
13  B8R1.8  C(CO)N1CCCC1 H0504 [0,1,0,1,0,0|2,0,0]=4
14  B8R2.25  C1CC2OC2C=C1 E0058 [0,0,0,2,0,0|0,0,2]=4