0  B13R0.54  CC(CCCCCCCCCCC)=O M10015126P [0,0,0,0,0,0|1,0,0]=1
1  B13R0.54  CC(OCCCCCCCCCC)=O M10003875P [0,0,0,0,0,0|2,0,0]=2
2  B12R0.5  CCCCCCCCCCCCC M10017053P [1,0,0,0,0,0|1,0,1]=3
3  B12R0.5  CCCCCCCCCCCCI M10061737P [1,0,0,0,0,0|1,0,1]=3
4  B12R0.5  CCCCCCSCCCCCC M10087464P [1,0,0,0,0,0|2,0,1]=4
5  B12R0.5  OCCCCCCCCCCCO M10020136P [1,0,0,0,0,0|1,0,1]=3
6  B12R0.5  OCCCCCCCCCCCS M10452846P [1,0,0,0,0,0|1,0,1]=3
7  B12R0.234  O=C(O)CCCCCCCCCO M10034672P [1,0,0,0,0,0|1,0,0]=2
8  B14R0.88  O=S(OCCCCCCCCCC)([O-])=O M10005451P [0,1,0,0,0,0|2,0,1]=4
9  B14R0.337  O=C(OC)CCCCCCCCCCBr M10087151P [0,1,0,0,0,0|1,0,0]=2
10  B11R0.3  C=CCCCCCCCCCBr M10110416P [2,0,0,0,0,0|1,0,1]=4
11  B11R0.3  C=CCCCCCCCCCC M10003899P [2,0,0,0,0,0|0,0,1]=3
12  B11R0.3  ClCCCCCCCCCCCl M10040667P [2,0,0,0,0,0|2,0,0]=4
13  B11R0.3  ICCCCCCCCCCI M10142330P [2,0,0,0,0,0|2,0,0]=4
14  B11R0.3  O=CCCCCCCCCCBr M10504722P [2,0,0,0,0,0|1,0,0]=3
15  B11R0.148  C=CCCCCCCCC(O)=O M10131075P [2,0,0,0,0,0|0,0,2]=4
16  B13R0.336  CCCCCCCCCCCCCBr M10020139P [1,1,0,0,0,0|1,0,1]=4
17  B13R0.336  OCCCCCCCCCCCCBr M10053548P [1,1,0,0,0,0|0,0,1]=3
18  B15R0.84  CCCCCCCCCCCC(N(C)C)=O M10050086P [0,2,0,0,0,0|1,0,0]=3
19  B15R0.164  O=C(Cl)OCCCCCCCCCCCC M10184967P [0,2,0,0,0,0|1,0,0]=3