0  B28R3.3889344072  C/C(=C\C1=CC=C(C=C1)C(=O)O)/C2=CC=C3C(=C2)C(CCC3(C)C)(C)C MCULE-7174437105 [0,0,0,0,0,0|0,0,0]=0
1  B28R3.3889344072  CC(=CC1=CC=C(C=C1)C(=O)O)C2=CC3=C(C=C2)C(CCC3(C)C)(C)C MCULE-9052962830 [0,0,0,0,0,0|0,0,0]=0
2  B28R3.3889344072  CC1(CCC(C2=CC(=CC=C12)C(=O)NC3=CC=C(C=C3)C(=O)O)(C)C)C MCULE-3824063031 [0,0,0,0,0,0|2,0,0]=2
3  B27R3.1508760074  CC1(CCC(C2=CC(=CC=C12)C#CC3=CC=C(C=C3)C(=O)O)(C)C)C MCULE-8693379849 [1,0,0,0,0,0|0,0,2]=3
4  B29R3.9978241431  CC(=CC1=CC=C(C=C1)S(=O)(=O)C)C2=CC=C3C(=C2)C(CCC3(C)C)(C)C MCULE-1125815358 [0,1,0,0,0,0|1,0,1]=3
5  B29R3.9916034604  CC1(CCC(C2=CC(=CC=C12)C(=O)C=CC3=CC=C(C=C3)C(=O)O)(C)C)C MCULE-2953295769 [0,0,0,0,0,1|1,0,0]=2
6  B26R3.930021279  CC(=CC1=CC=C(C=C1)O)C2=CC=C3C(=C2)C(CCC3(C)C)(C)C MCULE-5303021725 [2,0,0,0,0,0|0,0,0]=2
7  B28R3.3439404523  CCSC1=CC=C(C=C1)C=C(C)C2=CC=C3C(=C2)C(CCC3(C)C)(C)C MCULE-6204370548 [1,1,0,0,0,0|1,0,1]=4
8  B28R3.3889362316  CC1(CCC(C2=C1C=CC(=C2)NC(=O)C3=CC=C(C=C3)C(=O)O)(C)C)C MCULE-9332704918 [1,1,0,0,0,0|1,0,0]=3
9  B28R3.3832030349  CC(=CC1=CC(=CS1)C(=O)O)C2=CC3=C(C=C2C)C(CCC3(C)C)(C)C MCULE-7302870282 [0,1,0,0,1,0|1,0,0]=3
10  B28R3.3832030349  CC(=CC1=CC=C(O1)C(=O)O)C2=CC3=C(C=C2C)C(CCC3(C)C)(C)C MCULE-7524380686 [0,1,0,0,1,0|1,0,0]=3
11  B28R3.3831974926  C=C(C1=CC=C(C=C1)C(=O)O)C2=CC3=C(C=C2C)C(CCC3(C)C)(C)C MCULE-3783114634 [0,1,0,0,1,0|0,0,1]=3
12  B28R3.3831974926  CC1=C(C=C2C(=C1)C(CCC2(C)C)(C)C)C(=O)C3=CC=C(C=C3)C(=O)O MCULE-3031262739 [0,1,0,0,1,0|1,0,0]=3
13  B30R3.10328516261  CCS(=O)(=O)C1=CC=C(C=C1)C=C(C)C2=CC=C3C(=C2)C(CCC3(C)C)(C)C MCULE-4102478842 [0,2,0,0,0,0|1,0,1]=4
14  B30R3.11669193064  CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC3=C(C=C2)C(CCC3(C)C)(C)C MCULE-5441544484 [0,2,0,0,0,0|2,0,0]=4
15  B28R3.3893633952  CC(=CC1=CC=CC(=C1)C(=O)O)C2=CC=C3C(=C2)C(CCC3(C)C)(C)C MCULE-5828521120 [0,0,0,0,1,1|0,0,0]=2