0  B25R3.56151831  CNCCCC1(OCC2=C1C=CC(=C2)C#N)C3=CC=C(C=C3)F MCULE-9088924507 [0,0,0,0,0,0|0,0,0]=0
1  B25R3.56151831  CNCCCC1(OCC2=CC(=CC=C12)C#N)C3=CC=C(C=C3)F MCULE-3934230443 [0,0,0,0,0,0|0,0,0]=0
2  B25R3.56151831  CNCCC[C@]1(OCC2=C1C=CC(=C2)C#N)C3=CC=C(C=C3)F MCULE-3097706720 [0,0,0,0,0,0|0,0,0]=0
3  B25R3.56151831  CNCCC[C@]1(OCC2=C1C=CC(=C2)C#N)C3=CC=C(C=C3)F MCULE-7931695223 [0,0,0,0,0,0|0,0,0]=0
4  B26R3.11436669  CN(C)CCCC1(OCC2=C1C=CC(=C2)C#N)C3=CC=C(C=C3)F MCULE-1873395892 [0,1,0,0,0,0|0,0,0]=1
5  B26R3.11436669  CN(C)CCCC1(OCC2=CC(=CC=C12)C#N)C3=CC=C(C=C3)F MCULE-5882770916 [0,1,0,0,0,0|0,0,0]=1
6  B26R3.11436669  CN(C)CCC[C@@]1(OCC2=C1C=CC(=C2)C#N)C3=CC=C(C=C3)F MCULE-2549319698 [0,1,0,0,0,0|0,0,0]=1
7  B26R3.11436669  CN(C)CCC[C@@]1(OCC2=C1C=CC(=C2)C#N)C3=CC=C(C=C3)F MCULE-8566721168 [0,1,0,0,0,0|0,0,0]=1
8  B26R3.11436669  CN(C)CCC[C@@]1(OCC2=CC(=CC=C12)C#N)C3=CC=C(C=C3)F MCULE-6009436381 [0,1,0,0,0,0|0,0,0]=1
9  B26R3.11436669  CN(C)CCC[C@@]1(OCC2=CC(=CC=C12)C#N)C3=CC=C(C=C3)F MCULE-9546560466 [0,1,0,0,0,0|0,0,0]=1
10  B26R3.11436669  CN(C)CCC[C@]1(OCC2=C1C=CC(=C2)C#N)C3=CC=C(C=C3)F MCULE-7670640212 [0,1,0,0,0,0|0,0,0]=1
11  B26R3.11436669  CN(C)CCC[C@]1(OCC2=CC(=CC=C12)C#N)C3=CC=C(C=C3)F MCULE-1806848795 [0,1,0,0,0,0|0,0,0]=1
12  B26R3.11436669  CN(C)CCC[C@]1(OCC2=CC(=CC=C12)C#N)C3=CC=C(C=C3)F MCULE-2502719926 [0,1,0,0,0,0|0,0,0]=1
13  B26R3.11436669  CN(C)CCC[C@]1(OCC2=CC(=CC=C12)C#N)C3=CC=C(C=C3)F MCULE-3600224873 [0,1,0,0,0,0|0,0,0]=1
14  B26R3.11436669  C[NH+](C)CCCC1(OCC2=C1C=CC(=C2)C#N)C3=CC=C(C=C3)F MCULE-1202550254 [0,1,0,0,0,0|0,0,1]=2
15  B25R3.448640107  CN(C)CCCC1(OCC2=C1C=CC(=C2)Br)C3=CC=C(C=C3)F MCULE-8741718090 [1,1,0,0,0,0|1,0,0]=3
16  B27R3.124869282  CN(C)CCCC1(OC(=O)C2=C1C=CC(=C2)C#N)C3=CC=C(C=C3)F MCULE-6918176838 [0,2,0,0,0,0|0,0,1]=3
17  B27R3.124869282  CN(C)CCCC1(OC(C2=CC(=CC=C12)C#N)O)C3=CC=C(C=C3)F MCULE-4283983488 [0,2,0,0,0,0|0,0,0]=2