0  B33R0.14128  CCCCCCCCCCCCCCCC(=O)OCCCSCCCCCCCCCCCC MCULE-9255125601 [0,0,0,0,0,0|1,0,0]=1
1  B33R0.14128  CCCCCCCCCCCCCCCCCC(=O)NCCCCCCCCCCCCCC MCULE-9271025898 [0,0,0,0,0,0|2,0,0]=2
2  B33R0.14128  CCCCCCCCCCCCCCCCCC(=O)OCCCCCCCCCCCCCC MCULE-2910191036 [0,0,0,0,0,0|2,0,0]=2
3  B33R0.14128  CCCCCCCCCCCCCCCCOC(=O)CCCCCCCCCCCCCCC MCULE-7099724921 [0,0,0,0,0,0|0,0,0]=0
4  B32R0.16283  CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC MCULE-2429489298 [1,0,0,0,0,0|1,0,1]=3
5  B32R0.16283  CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCO MCULE-3265282762 [1,0,0,0,0,0|2,0,1]=4
6  B32R0.16283  CCCCCCCCCCCCCCCCNCCCCCCCCCCCCCCCC MCULE-6073841791 [1,0,0,0,0,0|1,0,1]=3
7  B32R0.16283  CCCCCCCCCCCCCCCCOCCCCCCCCCCCCCCCC MCULE-4055435661 [1,0,0,0,0,0|0,0,1]=2
8  B32R0.16283  CCCCCCCCCCCCCCCCSCCCCCCCCCCCCCCCC MCULE-4731411960 [1,0,0,0,0,0|0,1,1]=3
9  B32R0.20248  CCCCCCCCCCCCCCCCCC(=O)OCCCCCCCCCCCCC MCULE-2685538579 [1,0,0,0,0,0|2,0,0]=3
10  B34R0.7328  CCCCCCCCCCCCCCCC(=O)CC(=O)CCCCCCCCCCCCCCC MCULE-5052034886 [0,1,0,0,0,0|1,0,1]=3
11  B34R0.7328  CCCCCCCCCCCCCCCC(=O)OC(=O)CCCCCCCCCCCCCCC MCULE-2386341711 [0,1,0,0,0,0|0,0,1]=2
12  B31R0.5208  CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC MCULE-7869891120 [2,0,0,0,0,0|0,0,1]=3
13  B31R0.12719  CCCCCCCCCCCCCCCC(=O)CCCCCCCCCCCCCCC MCULE-1539628749 [2,0,0,0,0,0|0,0,0]=2
14  B31R0.10404  CCCCCCCCCCCCCCCCCC(=O)NCCCCCCCCCCCC MCULE-1464098834 [2,0,0,0,0,0|2,0,0]=4
15  B31R0.10404  CCCCCCCCCCCCCCCCCC(=O)OCCCCCCCCCCCC MCULE-8800021203 [2,0,0,0,0,0|2,0,0]=4
16  B31R0.10404  CCCCCCCCCCCCCCCCOC(=O)CCCCCCCCCCCCC MCULE-1658713625 [2,0,0,0,0,0|0,0,0]=2
17  B33R0.476692  CCCCCCCCCCCCCCCCC(=O)CCCCCCCCCCCCCCCC MCULE-5841372551 [1,1,0,0,0,0|0,0,0]=2
18  B33R0.2535409  CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC MCULE-4986493699 [1,1,0,0,0,0|1,0,1]=4
19  B35R0.892124  CCCCCCCCCCCCCCCCCCOC(=O)CCCCCCCCCCCCCCC MCULE-2821419023 [0,2,0,0,0,0|0,0,0]=2
20  B35R0.65910011  CCCCCCCCCCCCCCCC(=O)OCC(O)COC(=O)CCCCCCCCCCC MCULE-8624420476 [0,2,0,0,0,0|1,0,1]=4
21  B35R0.894843  CCCCCC=CCC=CCCCCCCCC(=O)OCCCCCCCCCCCCCCCC MCULE-2783108235 [0,2,0,0,0,0|0,0,2]=4
22  B35R0.894843  CCCCCCCCCCCCCCCCCC(=O)CCCCCCCCCCCCCCCCC MCULE-6790736802 [0,2,0,0,0,0|1,0,0]=3