0  B7R0.2  COC(=O)C[C@@H](C)O H0102 [1,0,0,0,0,0|2,0,0]=3
1  B6R0.2  CC(O)CC([O-])=O H0080 [2,0,0,0,0,0|1,0,1]=4
2  B8R1.5  BrC1CCCCC1=O B0249 [1,0,0,1,0,0|1,0,1]=4
3  B8R1.19  CC1(C)CCCC1=O D0333 [1,0,0,1,0,0|1,0,1]=4