0  B13R0.54  CCCCCCCCC\C=C\C(=O)O W16764 [0,0,0,0,0,0|0,0,2]=2
1  B13R0.54  NCCOCCOCCOCC(=O)O C70201 [0,0,0,0,0,0|4,0,0]=4
2  B13R0.54  O=C(O)COCCOCCOCCCl D86084 [0,0,0,0,0,0|4,0,0]=4
3  B13R0.54  O=C(O)COCCOCCOCCO AT11302 [0,0,0,0,0,0|4,0,0]=4
4  B12R0.234  CC(=O)OCCCCCCCCBr F11873 [1,0,0,0,0,0|3,0,0]=4
5  B14R0.394  N#CCCCCCCCCCCC(=O)O FD10458 [0,1,0,0,0,0|0,0,1]=2
6  B14R0.394  NCCOCCOCCOCCC(=O)O E72613 [0,1,0,0,0,0|3,0,0]=4
7  B14R0.394  O=C(O)CCOCCOCCOCCS S10523 [0,1,0,0,0,0|3,0,0]=4
8  B14R1.4728  CCCCCCCCC1=C[C@H]1C(=O)O F16577 [0,0,0,1,0,0|0,0,2]=3
9  B13R0.165  CCCCCCC(N)CCCCCC T72111 [1,1,0,0,0,0|1,0,1]=4
10  B13R0.336  C=CCCCCCCCCCCC=C T72093 [1,1,0,0,0,0|1,0,1]=4
11  B13R0.150  CCCCCCCCC[C@H](N)C(=O)O W16890 [1,1,0,0,0,0|0,0,0]=2
12  B13R0.280  CCCCCCCCCCP(=O)(O)O T71228 [1,1,0,0,0,0|1,0,0]=3
13  B15R0.2662  [2H]C([2H])([2H])CCCCCCCCCC(=O)O D98423 [0,2,0,0,0,0|1,0,0]=3
14  B15R0.214  CCCCC(=O)NCCCC[C@H](N)C(=O)O F16303 [0,2,0,0,0,0|1,0,1]=4
15  B15R0.1626  [2H]C([2H])(CCCCCCCCCC)C(=O)O D98827 [0,2,0,0,0,0|0,0,0]=2
16  B15R0.1626  [2H]C([2H])(CCCCCCCCCC)C(=O)[O-] D98152 [0,2,0,0,0,0|0,0,1]=3
17  B13R1.119  O=CCCCCCOC1CCCC1 P16979 [1,0,0,1,0,0|1,0,0]=3
18  B15R1.12  CCCCCCCCC1CCC(=O)CC1 W17271 [0,1,0,1,0,0|1,0,0]=3
19  B15R1.497  O=C(O)CCCNC(=O)C1CCCCC1 F21080 [0,1,0,1,0,0|1,0,1]=4
20  B15R1.3995  CC\C=C/C[C@@H]1[C@@H](O)CC[C@@H]1CC(=O)O T70206 [0,1,0,1,0,0|0,0,2]=4
21  B15R2.1428  CCCCC1OC(=O)C2=CCCCC21 42909 [0,0,0,2,0,0|0,0,2]=4