0  B4R0.1  C#CC(O)C B0123 [1,0,0,0,0,0|2,0,1]=4
1  B4R0.2  CC\C=N\O P0059 [1,0,0,0,0,0|2,1,0]=4
2  B5R0.4  CNC(C)(C)C M0515 [1,1,0,0,0,0|0,0,2]=4