0  B11R0.148  CCCCCCCCCC(=O)[O-] 29720 [0,0,0,0,0,0|0,0,3]=3
1  B11R0.148  CCCCCCCCC[C@H](C)O 15557 [0,0,0,0,0,0|1,0,3]=4
2  B10R0.4  C=CCCCCCCC(=O)O 27146 [1,0,0,0,0,0|0,0,3]=4
3  B10R0.4  CCCCCCCCB(O)O 29487 [1,0,0,0,0,0|1,0,2]=4
4  B10R0.4  NCCCCCCCC(=O)O 13165 [1,0,0,0,0,0|1,0,1]=3
5  B12R0.4  CCCCCCCC(O)CC(=O)O 35410 [0,1,0,0,0,0|0,0,2]=3
6  B12R0.234  O=C(O)CCCCCCCCCO 25651 [0,1,0,0,0,0|0,0,2]=3
7  B12R0.248  COC(=O)CCCCCCCCO 18968 [0,1,0,0,0,0|1,0,2]=4
8  B12R1.252  O=C(O)CCCC1CCCCC1 15521 [0,0,0,1,0,0|0,0,2]=3
9  B9R0.2  CCCCCCCC(=O)[O-] 12870 [2,0,0,0,0,0|0,0,1]=3
10  B9R0.45  CCCCCC#CCCO 13073 [2,0,0,0,0,0|0,0,2]=4
11  B11R0.46  CCCCOC(=O)CCC(C)=O 11224 [1,1,0,0,0,0|2,0,0]=4
12  B11R0.147  CCCCC(O)CCCC(=O)O 9714 [1,1,0,0,0,0|0,0,1]=3
13  B13R0.54  CCCCCCCCC\C=C\C(=O)O 17485 [0,2,0,0,0,0|0,0,2]=4
14  B13R0.54  CCCCCCCCC\C=C\C(=O)O 17492 [0,2,0,0,0,0|0,0,2]=4
15  B11R1.91  O=C(O)CCC1CCCCC1 20248 [1,0,0,1,0,0|0,0,1]=3
16  B11R1.91  O=C(O)CCC1CCNCC1 19136 [1,0,0,1,0,0|1,0,1]=4
17  B11R1.143  N[C@@H]1CCCCC[C@@H]1C(=O)O 23253 [1,0,0,1,0,0|1,0,1]=4
18  B11R1.172  O=C(O)CCCN1CCCC1 23548 [1,0,0,1,0,0|1,0,1]=4
19  B11R1.742  O=C(O)CC1CCCCCC1 16200 [1,0,0,1,0,0|0,0,1]=3
20  B11R1.17  CCCCC1CCCCC1=O 20238 [1,0,0,1,0,0|0,0,2]=4