0  B27R1.245962247  CCCCCCCC(=O)CC[C@H]1[C@@H](C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O MCULE-7672258685 [0,0,0,0,0,0|0,0,0]=0
1  B27R1.245962247  CCCCCCCC(=O)CC[C@H]1[C@@H](C[C@@H]([C@@H]1CC=CCCCC(=O)O)O)O MCULE-8861302899 [0,0,0,0,0,0|0,0,0]=0
2  B27R1.245962247  CCCCCCC[C@H](O)C=C[C@H]1[C@@H](C[C@@H]([C@@H]1CC=CCCCC(=O)O)O)O MCULE-6630343730 [0,0,0,0,0,0|0,0,4]=4
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4  B25R1.56693979  CCCCCC(=O)C=C[C@@H]1[C@@H]([C@@H](C[C@H]1O)O)CC=CCCCC(=O)O MCULE-4936671234 [2,0,0,0,0,0|0,0,2]=4
5  B25R1.56693979  CCCCCC(=O)C=C[C@@H]1[C@@H]([C@H](C[C@H]1O)O)CC=CCCCC(=O)O MCULE-3676135887 [2,0,0,0,0,0|0,0,2]=4
6  B25R1.56693979  CCCCCC(=O)C=C[C@H]1[C@@H](C[C@@H]([C@@H]1CC=CCCCC(=O)O)O)O MCULE-1591082425 [2,0,0,0,0,0|0,0,2]=4
7  B25R1.56693979  CCCCCC(=O)CC[C@@H]1[C@@H]([C@H](C[C@H]1O)O)CC=CCCCC(=O)O MCULE-8894804726 [2,0,0,0,0,0|0,0,0]=2
8  B25R1.56693979  CCCCCC(=O)CC[C@H]1[C@@H](CC(=O)[C@@H]1CC=CCCCC(=O)O)O MCULE-3788610800 [2,0,0,0,0,0|0,0,2]=4
9  B25R1.56693979  CCCCCC(=O)CC[C@H]1[C@@H](C[C@@H]([C@@H]1CC=CCCCC(=O)O)O)O MCULE-4478254575 [2,0,0,0,0,0|0,0,0]=2
10  B25R1.56693979  CCCCCC(=O)CC[C@H]1[C@@H](C[C@@H]([C@@H]1CCCCCCC(=O)O)O)O MCULE-8872510615 [2,0,0,0,0,0|0,0,2]=4
11  B25R1.56693979  CCCCC[C@H](O)CC[C@H]1[C@@H](C[C@@H]([C@@H]1CC=CCCCC(=O)O)O)O MCULE-6703714458 [2,0,0,0,0,0|0,0,2]=4
12  B29R1.405572516  CCCCCCCC(=O)CC[C@H]1[C@@H](C[C@@H]([C@@H]1CC=CCCCC(=O)NCC)O)O MCULE-8474652158 [0,2,0,0,0,0|1,0,0]=3