0  B13R0.54  O=C(O)CCCCCCCCCCBr B39661 [0,0,0,0,0,0|3,0,0]=3
1  B13R0.54  O=C(O)CCCCCCCCCCS M31896 [0,0,0,0,0,0|3,0,0]=3
2  B12R0.5  CCCCCCCCCCCCO D64921 [1,0,0,0,0,0|1,0,2]=4
3  B12R0.5  CCCCCCCCCCN=[N+]=[N-] A1900 [1,0,0,0,0,0|3,0,0]=4
4  B12R0.5  CCOCCCCCCCCCO E64231 [1,0,0,0,0,0|1,0,1]=3
5  B12R0.234  CCCCCCCCCCB(O)O D53367 [1,0,0,0,0,0|2,0,1]=4
6  B12R0.234  NCCCCCCCCCC(=O)O A53349 [1,0,0,0,0,0|2,0,0]=3
7  B12R0.234  O=C(O)CCCCCCCCCBr B53316 [1,0,0,0,0,0|2,0,0]=3
8  B14R0.340  CCCCCCCCCC[C@H](N)C(=O)O A56350 [0,1,0,0,0,0|2,0,0]=3
9  B11R0.3  C=CCCCCCCCCCBr B55096 [2,0,0,0,0,0|1,0,1]=4
10  B11R0.3  C=CCCCCCCCCCC D56327 [2,0,0,0,0,0|0,0,1]=3
11  B11R0.3  C=CCCCCCCCCCO U55141 [2,0,0,0,0,0|1,0,1]=4
12  B11R0.3  CCCCCCCCCCCO U67607 [2,0,0,0,0,0|0,0,2]=4
13  B11R0.148  NCCCCCCCCC(=O)O A50593 [2,0,0,0,0,0|2,0,0]=4
14  B11R0.148  O=C(O)CCCCCCCCBr B38107 [2,0,0,0,0,0|2,0,0]=4
15  B11R0.148  O=C(O)CCCCCCCCO H68316 [2,0,0,0,0,0|2,0,0]=4
16  B13R0.147  CCCCCCCCCCC(=O)OC M56343 [1,1,0,0,0,0|2,0,0]=4
17  B13R1.6  CCCCCC[C@H]1CCCC(=O)O1 H55090 [1,0,0,1,0,0|1,0,0]=3