0  B9R0.45  NCCNCCNCCN D00736 [0,0,0,0,0,0|0,0,0]=0
1  B8R0.4  CCOCCOCCO D08904 [1,0,0,0,0,0|3,0,0]=4
2  B9R0.2  CCCCCNCC(N)=O D05033 [1,1,0,0,0,0|1,0,1]=4
3  B11R0.148  [*]NCCNCCNCC(=O)O D04734 [0,2,0,0,0,0|1,0,1]=4