0  B44R4.6773415007  CC12CCC3C4=C(C=C(C=C4)O)CC(C3C1CCC2O)CCCCCCCCCS(=O)CCCC(F)(F)C(F)(F)F MCULE-1923306179 [0,0,0,0,0,0|0,0,0]=0
1  B44R4.6773415007  C[C@]12CC[C@@H]3C4=C(C=C(C=C4)O)C[C@H]([C@H]3[C@@H]1CC[C@@H]2O)CCCCCCCCCS(=O)CCCC(F)(F)C(F)(F)F MCULE-1913008310 [0,0,0,0,0,0|0,0,0]=0
2  B44R4.6773415007  [C@H]12CC[C@@]3([C@H](CC[C@H]3[C@@H]1[C@@H](CC4=C2C=CC(=C4)O)CCCCCCCCCS(=O)CCCC(F)(F)C(F)(F)F)O)C MCULE-8546023611 [0,0,0,0,0,0|0,0,0]=0
3  B44R4.6773415007  [C@H]12CC[C@@]3([C@H](CC[C@H]3[C@@H]1[C@@H](CC4=C2C=CC(=C4)O)CCCCCCCCC[S@@](=O)CCCC(F)(F)C(F)(F)F)O)C MCULE-9435602803 [0,0,0,0,0,0|0,0,0]=0
4  B44R4.6773415007  [C@H]12CC[C@@]3([C@H](CC[C@H]3[C@@H]1[C@@H](CC4=C2C=CC(=C4)O)CCCCCCCCC[S@](=O)CCCC(F)(F)C(F)(F)F)O)C MCULE-5511785914 [0,0,0,0,0,0|0,0,0]=0
5  B43R4.6089992311  C[C@]12CC[C@@H]3C4=CC=C(C=C4C[C@H]([C@H]3[C@@H]1CC[C@@H]2O)CCCCCCCCCSCCCC(F)(F)C(F)(F)F)O MCULE-8475585223 [1,0,0,0,0,0|0,0,1]=2
6  B43R4.6089992311  [C@H]12CC[C@@]3([C@H](CC[C@H]3[C@@H]1[C@@H](CC4=C2C=CC(=C4)O)CCCCCCCCCSCCCC(F)(F)C(F)(F)F)O)C MCULE-7894619655 [1,0,0,0,0,0|0,0,1]=2
7  B45R4.5868758948  CC12CCC3C4=C(C=C(C=C4)O)CC(C3C1CCC2O)CCCCCCCCCS(=O)(=O)CCCC(F)(F)C(F)(F)F MCULE-9810296688 [0,1,0,0,0,0|0,0,1]=2
8  B45R4.5868758948  CC12CCC3C4=CC=C(C=C4C=C(C3C1CCC2O)CCCCCCCCCS(=O)(=O)CCCC(F)(F)C(F)(F)F)O MCULE-8242476816 [0,1,0,0,0,0|0,0,3]=4
9  B45R4.5868758948  C[C@]12CCC3C4=CC=C(C=C4C=C(C3C1CC[C@@H]2O)CCCCCCCCCS(=O)(=O)CCCC(F)(F)C(F)(F)F)O MCULE-1330192576 [0,1,0,0,0,0|0,0,3]=4
10  B45R4.5868758948  [C@H]12CC[C@@]3([C@H](CC[C@H]3[C@@H]1[C@@H](CC4=CC(=CC=C24)O)CCCCCCCCCS(=O)(=O)CCCC(F)(F)C(F)(F)F)O)C MCULE-8368209759 [0,1,0,0,0,0|0,0,1]=2
11  B46R4.4937438334  C[C@@]12CC[C@H]3C4=CC=C(C=C4C[C@@H]([C@@H]3[C@H]1CC[C@H]2O)CCCCCCCCCS(=O)CCCC(F)(F)C(F)(F)F)B(O)O MCULE-2132304959 [0,2,0,0,0,0|0,0,0]=2
12  B46R4.4937438334  [C@H]12CC[C@@]3([C@H](CC[C@H]3[C@@H]1[C@@H](CC4=CC(=CC=C24)B(O)O)CCCCCCCCCS(=O)CCCC(F)(F)C(F)(F)F)O)C MCULE-1351290074 [0,2,0,0,0,0|0,0,0]=2