0  B4R0.1  C#CC(C)Br B0250 [1,0,0,0,0,0|2,0,1]=4
1  B4R0.1  C#CC(C)O B0123 [1,0,0,0,0,0|1,1,1]=4
2  B4R0.2  CC\C=N\O P0059 [1,0,0,0,0,0|2,0,1]=4