0  B17R0.117  CCCCCCCCCCCCCCCCCO CS20705 [1,0,0,0,0,0|0,0,0]=1
1  B19R0.149  CCCCCCCCCCCCCCCCCC(=O)[O-] CS11167 [0,1,0,0,0,0|0,0,2]=3
2  B19R0.149  CCCCCCCC\C=C\CCCCCCCC(=O)O MC20980 [0,1,0,0,0,0|0,0,3]=4
3  B20R0.3034  CCCCCCCCCCCCCCCCNC(=O)CBr CS14034 [0,2,0,0,0,0|1,0,1]=4
4  B20R0.22320  CCCCCCCCCCCCCC(=O)OCC(O)CO MC438000 [0,2,0,0,0,0|1,0,1]=4
5  B20R0.32509  CCCCCCCCCCCCCCCCOP(=O)([O-])O CS10925 [0,2,0,0,0,0|2,0,0]=4
6  B20R0.9755  CCCCCCCCCCC(CN)CCCCCCCC MC446798 [0,2,0,0,0,0|1,0,0]=3
7  B20R0.9755  CCCCCCCCCCC(CO)CCCCCCCC CS21726 [0,2,0,0,0,0|1,0,0]=3
8  B20R1.3329  CCCCCCCCCCCCN1CCCCCC1=O CS11542 [0,1,0,1,0,0|0,0,2]=4