0  B37R4.5809735184  CC(=O)C1(CCC2C1(CCC3C2CCC4=CC(=NOCC(=O)NC(C)C(=O)O)CCC43C)C)O MCULE-2149232377 [0,0,0,0,0,0|0,0,0]=0
1  B37R4.5809735184  CC(=O)[C@]1(CCC2[C@@]1(CCC3C2CCC4=CC(=NOCC(=O)NC(C)C(=O)O)CC[C@@]43C)C)O MCULE-1978985274 [0,0,0,0,0,0|0,0,0]=0
2  B36R4.13770740018  CC(=O)[C@]1(CCC2[C@@]1(CCC3C2CCC4=CC(=NOCC(=O)NCC(=O)O)CC[C@@]43C)C)O MCULE-7013118242 [1,0,0,0,0,0|0,0,0]=1
3  B36R4.13770740018  [C@@H]12CC[C@]([C@]1(CC[C@H]3[C@H]2CCC4=CC(=NOCC(=O)NCC(=O)O)CC[C@]34C)C)(O)C(=O)C MCULE-2310972506 [1,0,0,0,0,0|0,0,0]=1
4  B36R4.16689724489  C#C[C@]1(CCC2[C@@]1(CCC3C2CCC4=CC(=NOCC(=O)NC(C)C(=O)O)CC[C@@]43C)C)O MCULE-2549263384 [1,0,0,0,0,0|0,0,2]=3
5  B38R4.7037280795  CC(=O)[C@]1(CCC2[C@@]1(CCC3C2CCC4=CC(=NOCC(=O)NC(CO)C(=O)O)CC[C@@]43C)C)O MCULE-7359630247 [0,1,0,0,0,0|0,0,0]=1
6  B38R4.7037280795  CC(=O)[C@]1(CCC2[C@@]1(CCC3C2CCC4=CC(=NOCC(=O)NC(CS)C(=O)O)CC[C@@]43C)C)O MCULE-2165075538 [0,1,0,0,0,0|0,0,0]=1
7  B35R4.3820875100  C#C[C@]1(CCC2[C@@]1(CCC3C2CCC4=CC(=NOCC(=O)NCC(=O)O)CC[C@@]43C)C)O MCULE-2539186604 [2,0,0,0,0,0|0,0,2]=4
8  B35R4.3313809003  [C@@H]12CCC3=CC(=NOCC(=O)NC(C)C(=O)O)CC[C@@]3(C1CC[C@]4(C2CC[C@]4(C)O)C)C MCULE-3698847821 [2,0,0,0,0,0|0,0,0]=2
9  B37R4.4681956152  C#C[C@]1(CCC2[C@@]1(CCC3C2CCC4=CC(=NOCC(=O)NC(CO)C(=O)O)CC[C@@]43C)C)O MCULE-8708626843 [1,1,0,0,0,0|0,0,2]=4
10  B37R4.4681956152  C#C[C@]1(CCC2[C@@]1(CCC3C2CCC4=CC(=NOCC(=O)NC(CS)C(=O)O)CC[C@@]43C)C)O MCULE-5093459377 [1,1,0,0,0,0|0,0,2]=4
11  B37R4.4681956157  [C@@H]12CCC3=CC(=NOCC(=O)NC(CO)C(=O)O)CC[C@@]3(C1CC[C@]4(C2CCC4C(=O)C)C)C MCULE-2127006968 [1,1,0,0,0,0|0,0,0]=2
12  B39R4.6961158735  CC(=O)C1(CCC2C1(CCC3C2CCC4=CC(=NOCC(=O)NC(C(=O)O)C(C)C)CCC43C)C)O MCULE-3307380808 [0,2,0,0,0,0|0,0,0]=2
13  B39R4.6961158735  CC(=O)[C@]1(CCC2[C@@]1(CCC3C2CCC4=CC(=NOCC(=O)NC(C(=O)O)C(C)C)CC[C@@]43C)C)O MCULE-9016690575 [0,2,0,0,0,0|0,0,0]=2
14  B39R4.6961158735  CC(=O)[C@]1(CCC2[C@@]1(CCC3C2CCC4=CC(=NOCC(=O)NC(C(=O)O)C(C)O)CC[C@@]43C)C)O MCULE-9720761643 [0,2,0,0,0,0|0,0,0]=2