0  B5R0.1  C=C(C)CCO NPA031414 [0,0,1,0,0,0|2,0,1]=4
1  B6R0.1  CCCC(=O)CC NPA012016 [0,1,1,0,0,0|0,1,1]=4
2  B6R0.4  CC(=O)CCSC NPA010578 [0,1,1,0,0,0|0,1,1]=4
3  B6R0.4  C[C@H](CCSC)O NPA014443 [0,1,1,0,0,0|0,1,0]=3
4  B8R1.2  C1CC=CC(C1)CO NPA024427 [0,1,0,0,0,1|0,1,1]=4
5  B8R1.52  C1C[C@@](OC1)(CO)O NPA010903 [0,2,0,0,0,0|1,1,0]=4
6  B6R1.1  C1CSCCS1 NPA010361 [0,0,1,1,0,0|1,0,0]=3
7  B8R1.22  C1CC=CCC(=O)C1 NPA016451 [0,0,0,0,0,2|0,1,1]=4