0  B4R0.2  CC\C=N\O P0059 [0,0,1,0,0,0|1,0,2]=4
1  B6R1.1  C1CC=CC=C1 C0259 [0,0,0,0,0,1|1,0,2]=4
2  B5R0.1  CNCC(O)=O S0121 [0,1,1,0,0,0|1,0,1]=4
3  B5R0.2  BrCCCC=C B0624 [0,1,1,0,0,0|1,0,1]=4
4  B5R0.3  OCC(Cl)CO C0752 [0,1,1,0,0,0|2,0,0]=4
5  B7R1.1  C1CCN(C1)N=O N0378 [0,2,0,0,0,0|0,0,0]=2
6  B7R1.4  O=C1NOC[C@H]1N D0356 [0,2,0,0,0,0|1,0,1]=4
7  B7R1.4  O=C1[C@@H]([NH3+])CCO1 H0310 [0,2,0,0,0,0|1,0,1]=4