0  B13R0.336  CCCCCCCCCC\C=C\C=O 793 [0,1,0,0,0,0|0,0,1]=2
1  B12R0.234  CCCCCCCCCOC(=O)C 771 [1,1,0,0,0,0|1,0,0]=3
2  B14R0.68  CC(C)CCCCCCC\C=C/C(=O)O 964 [0,2,0,0,0,0|0,0,2]=4