0  B12R0.42  CC(N)C(N)CCCCCC(=O)O RT0463 [0,0,0,0,0,0|1,0,1]=2
1  B12R0.42  C[C@H](N)C(=O)CCCCCC(=O)O RT0483 [0,0,0,0,0,0|0,0,0]=0
2  B11R0.30  CC(=O)NCCCCCC(=O)O LQ0010 [1,0,0,0,0,0|2,0,1]=4
3  B11R0.30  CC(C)\C=C/CCCCC(=O)O RT0249 [1,0,0,0,0,0|1,0,1]=3
4  B11R0.30  NC(N)=NCCCCCC(=O)O LQ3120 [1,0,0,0,0,0|2,0,1]=4
5  B13R1.350  C=C(C)C(=O)N1CCC[C@H]1C(=O)O RT12568 [0,0,0,1,0,0|2,0,1]=4
6  B10R0.4  CC(C)CCCCCCC=O RT1236 [2,0,0,0,0,0|1,0,1]=4
7  B10R0.4  CCCCCCCCC(=O)Cl XJ1343 [2,0,0,0,0,0|1,0,1]=4
8  B10R0.4  NCCCCCCCC(=O)O HL0564 [2,0,0,0,0,0|0,0,1]=3
9  B10R0.4  NCCCCCCNC(=O)O HL1567 [2,0,0,0,0,0|1,0,1]=4
10  B10R0.4  O=C(O)CCCCCCCBr LQ4065 [2,0,0,0,0,0|1,0,1]=4
11  B10R0.4  O=C(O)CCCCCCCO YH17816 [2,0,0,0,0,0|1,0,1]=4
12  B10R0.74  CCCCCCCC(=O)CC LQ1524 [2,0,0,0,0,0|1,0,1]=4
13  B10R0.97  CC(C)CCCCCC(=O)O JZ5722 [2,0,0,0,0,0|1,0,1]=4
14  B10R0.97  O=C(O)CCSCCC(=O)O XJ0379 [2,0,0,0,0,0|2,0,0]=4
15  B12R0.269  CC(C)(C)C(=O)NCCCC(=O)O YH66580 [0,1,0,0,1,0|2,0,0]=4
16  B14R0.71  O=C(O)CCCCCNC(=O)C(F)(F)F RT13307 [0,1,0,0,0,1|2,0,0]=4
17  B12R1.368  NCC(=O)N1CCC[C@@H]1C(=O)O YH15503 [1,0,0,1,0,0|1,0,0]=3
18  B12R1.368  NCC(=O)N1CCC[C@H]1C(=O)O RT5724 [1,0,0,1,0,0|1,0,0]=3
19  B14R1.1004  C[C@@H](CBr)C(=O)N1CCC[C@H]1C(=O)O RT16128 [0,1,0,1,0,0|2,0,0]=4
20  B14R1.1004  C[C@H](CBr)C(=O)N1CCC[C@H]1C(=O)O RT16127 [0,1,0,1,0,0|2,0,0]=4
21  B14R1.1004  [C@@H](C)(CS)C(=O)N1CCC[C@H]1C(=O)O RT16261 [0,1,0,1,0,0|2,0,0]=4
22  B10R0.55  COC(=O)CCCCC(=O)O HL0266 [1,0,0,0,1,0|1,0,0]=3