COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.837   1.792   0.723  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.478   0.095   0.266  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.225  -0.175  -0.528  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.917   0.265  -0.220  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.205  -0.217  -0.105  1.00  0.00           C  
HETATM    6  C   UNL     1      -6.453  -1.370   0.618  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.121  -1.576   1.118  1.00  0.00           C  
HETATM    8  C   UNL     1       6.584  -0.756  -0.129  1.00  0.00           C  
HETATM    9  C   UNL     1       4.208  -1.185   0.029  1.00  0.00           C  
HETATM   10  C   UNL     1       5.277  -0.281  -0.104  1.00  0.00           C  
HETATM   11  C   UNL     1       5.005   1.170  -0.215  1.00  0.00           C  
HETATM   12  O   UNL     1       5.925   1.956  -0.330  1.00  0.00           O  
HETATM   13  C   UNL     1       3.614   1.657  -0.187  1.00  0.00           C  
HETATM   14  C   UNL     1       2.559   0.760  -0.056  1.00  0.00           C  
HETATM   15  C   UNL     1       2.817  -0.682   0.056  1.00  0.00           C  
HETATM   16  O   UNL     1       1.890  -1.460   0.170  1.00  0.00           O  
HETATM   17  N   UNL     1       1.429   1.521  -0.064  1.00  0.00           N  
HETATM   18  N   UNL     1       1.777   2.755  -0.188  1.00  0.00           N  
HETATM   19  N   UNL     1       3.056   2.872  -0.263  1.00  0.00           N  
HETATM   20  C   UNL     1       0.119   1.045   0.044  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.130   1.322   0.836  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.516  -0.652  -0.415  1.00  0.00           C  
HETATM   23  F   UNL     1      -1.848  -1.840  -0.967  1.00  0.00           F  
HETATM   24  C   UNL     1      -3.865  -0.415   0.390  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.413  -2.046   1.231  1.00  0.00           C  
HETATM   26  C   UNL     1      -7.344   0.513  -0.769  1.00  0.00           C  
HETATM   27  O   UNL     1      -7.528   0.008  -2.093  1.00  0.00           O  
HETATM   28  F   UNL     1      -3.058   2.049   1.496  1.00  0.00           F  
HETATM   29  C   UNL     1       6.824  -2.116  -0.030  1.00  0.00           C  
HETATM   30  C   UNL     1       5.774  -3.006   0.094  1.00  0.00           C  
HETATM   31  C   UNL     1       4.467  -2.548   0.121  1.00  0.00           C  
HETATM   32  H   UNL     1      -0.566   2.738   1.167  1.00  0.00           H  
HETATM   33  H   UNL     1       0.520  -0.752  -1.055  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.725   1.165  -0.785  1.00  0.00           H  
HETATM   35  H   UNL     1      -7.463  -1.743   0.706  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.309  -2.107   1.593  1.00  0.00           H  
HETATM   37  H   UNL     1       7.409  -0.067  -0.231  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.613  -2.945   1.795  1.00  0.00           H  
HETATM   39  H   UNL     1      -8.257   0.363  -0.193  1.00  0.00           H  
HETATM   40  H   UNL     1      -7.115   1.578  -0.815  1.00  0.00           H  
HETATM   41  H   UNL     1      -8.246   0.433  -2.580  1.00  0.00           H  
HETATM   42  H   UNL     1       7.839  -2.485  -0.050  1.00  0.00           H  
HETATM   43  H   UNL     1       5.973  -4.065   0.166  1.00  0.00           H  
HETATM   44  H   UNL     1       3.650  -3.248   0.219  1.00  0.00           H  
CONECT    1   21   20   20   32                                       
CONECT    2   24   21   21   22                                       
CONECT    3   22   22   20   33                                       
CONECT    4   24   24    5   34                                       
CONECT    5    6    6    4   26                                       
CONECT    6   25    5    5   35                                       
CONECT    7   25   25   24   36                                       
CONECT    8   29   29   10   37                                       
CONECT    9   31   15   10   10                                       
CONECT   10    9    9    8   11                                       
CONECT   11   10   13   12   12                                       
CONECT   12   11   11                                                 
CONECT   13   14   14   11   19                                       
CONECT   14   15   17   13   13                                       
CONECT   15   16   16    9   14                                       
CONECT   16   15   15                                                 
CONECT   17   20   14   18                                            
CONECT   18   17   19   19                                            
CONECT   19   13   18   18                                            
CONECT   20    1    1    3   17                                       
CONECT   21   28    2    2    1                                       
CONECT   22    2   23    3    3                                       
CONECT   23   22                                                      
CONECT   24    7    2    4    4                                       
CONECT   25    7    7    6   38                                       
CONECT   26    5   27   39   40                                       
CONECT   27   26   41                                                 
CONECT   28   21                                                      
CONECT   29   30    8    8   42                                       
CONECT   30   31   31   29   43                                       
CONECT   31   30   30    9   44                                       
CONECT   32    1                                                      
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    6                                                      
CONECT   36    7                                                      
CONECT   37    8                                                      
CONECT   38   25                                                      
CONECT   39   26                                                      
CONECT   40   26                                                      
CONECT   41   27                                                      
CONECT   42   29                                                      
CONECT   43   30                                                      
CONECT   44   31                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
