0  B5R0.3  OCC(Cl)CO C0752 [0,0,0,0,0,0|1,0,0]=1
1  B4R0.1  C#CC(O)C B0123 [1,0,0,0,0,0|1,0,1]=3
2  B4R0.2  CC\C=N\O P0059 [1,0,0,0,0,0|2,0,1]=4
3  B6R0.3  OC[C@H](C)C([O-])=O H0292 [0,1,0,0,0,0|1,0,2]=4
4  B5R0.2  BrCCCC=C B0624 [1,1,0,0,0,0|2,0,0]=4
5  B7R0.10  C(C(C(CS)O)O)S D0323 [0,2,0,0,0,0|0,1,0]=3
6  B7R0.10  OCC(C)C(O[Na])=O H0085 [0,2,0,0,0,0|1,0,1]=4
7  B7R0.18  NC(CO)(CO)CO T0244 [0,2,0,0,0,0|0,0,0]=2