0  B9R0.2  CCCCCCOC(=O)C 726 [1,0,0,0,0,0|0,0,0]=1
1  B9R0.45  CCCCCCCCCO 770 [1,0,0,0,0,0|1,0,2]=4
2  B11R0.46  CCCCOC(=O)CCC(=O)C 734 [0,1,0,0,0,0|2,0,1]=4
3  B8R0.7  CCCCCCC(=O)C 764 [2,0,0,0,0,0|0,0,0]=2
4  B12R0.234  CCCCCCCCCOC(=O)C 771 [0,2,0,0,0,0|0,0,0]=2