0  B7R0.3  CCC(C)CCCO NPA009905 [0,1,0,0,0,0|1,1,1]=4
1  B7R0.3  CCCCC(C)C=C NPA006261 [0,1,0,0,0,0|2,0,1]=4
2  B7R0.4  CC(C)CCNC=O NPA028555 [0,1,0,0,0,0|0,1,2]=4
3  B6R0.4  C[C@H](CCSC)O NPA014443 [1,1,0,0,0,0|1,0,1]=4