COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.804   0.701  -0.012  1.00  0.00           C  
HETATM    2  C   UNL     1       5.709  -0.149  -0.090  1.00  0.00           C  
HETATM    3  C   UNL     1       5.476  -0.817  -1.293  1.00  0.00           C  
HETATM    4  C   UNL     1       9.222   2.090   0.144  1.00  0.00           C  
HETATM    5  C   UNL     1       7.101   1.445   1.262  1.00  0.00           C  
HETATM    6  C   UNL     1       4.016  -2.538   0.851  1.00  0.00           C  
HETATM    7  C   UNL     1       1.654  -2.862   0.542  1.00  0.00           C  
HETATM    8  C   UNL     1       2.552  -0.649   0.665  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.998  -1.888   0.608  1.00  0.00           C  
HETATM   10  C   UNL     1       0.107  -0.872   0.326  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.330  -1.316   0.197  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.089  -0.589   0.181  1.00  0.00           C  
HETATM   13  C   UNL     1      -6.581   1.252  -0.164  1.00  0.00           C  
HETATM   14  N   UNL     1      -6.876   3.908  -0.910  1.00  0.00           N  
HETATM   15  C   UNL     1      -5.815   3.624   0.066  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.535   4.354  -0.345  1.00  0.00           C  
HETATM   17  C   UNL     1      -6.254   4.103   1.451  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.556   2.139   0.107  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.295   1.668   0.416  1.00  0.00           C  
HETATM   20  C   UNL     1      -6.347  -0.111  -0.127  1.00  0.00           C  
HETATM   21  C   UNL     1      -7.467  -1.075  -0.424  1.00  0.00           C  
HETATM   22  F   UNL     1      -6.991  -2.387  -0.326  1.00  0.00           F  
HETATM   23  F   UNL     1      -8.502  -0.885   0.497  1.00  0.00           F  
HETATM   24  F   UNL     1      -7.946  -0.849  -1.719  1.00  0.00           F  
HETATM   25  C   UNL     1      -4.057   0.300   0.454  1.00  0.00           C  
HETATM   26  N   UNL     1      -2.781  -0.181   0.767  1.00  0.00           N  
HETATM   27  O   UNL     1      -2.996  -1.876  -0.648  1.00  0.00           O  
HETATM   28  C   UNL     1      -0.708  -3.156  -0.203  1.00  0.00           C  
HETATM   29  C   UNL     1       0.518  -3.842   0.396  1.00  0.00           C  
HETATM   30  C   UNL     1       1.464  -1.499   0.517  1.00  0.00           C  
HETATM   31  C   UNL     1       2.934  -3.378   0.707  1.00  0.00           C  
HETATM   32  C   UNL     1       3.827  -1.163   0.831  1.00  0.00           C  
HETATM   33  O   UNL     1       4.887  -0.325   0.976  1.00  0.00           O  
HETATM   34  C   UNL     1       6.334  -0.611  -2.352  1.00  0.00           C  
HETATM   35  N   UNL     1       7.367   0.204  -2.243  1.00  0.00           N  
HETATM   36  C   UNL     1       7.628   0.855  -1.118  1.00  0.00           C  
HETATM   37  C   UNL     1       8.615   1.591   1.427  1.00  0.00           C  
HETATM   38  O   UNL     1      10.172   2.843   0.185  1.00  0.00           O  
HETATM   39  N   UNL     1       8.729   1.708  -1.046  1.00  0.00           N  
HETATM   40  H   UNL     1       4.635  -1.486  -1.392  1.00  0.00           H  
HETATM   41  H   UNL     1       6.643   2.434   1.221  1.00  0.00           H  
HETATM   42  H   UNL     1       6.695   0.892   2.109  1.00  0.00           H  
HETATM   43  H   UNL     1       5.007  -2.947   0.982  1.00  0.00           H  
HETATM   44  H   UNL     1       2.403   0.420   0.650  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.014  -2.127   1.671  1.00  0.00           H  
HETATM   46  H   UNL     1       0.016  -0.518  -0.701  1.00  0.00           H  
HETATM   47  H   UNL     1       0.002  -0.028   1.007  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.908  -1.653   0.214  1.00  0.00           H  
HETATM   49  H   UNL     1      -7.566   1.623  -0.406  1.00  0.00           H  
HETATM   50  H   UNL     1      -7.733   3.437  -0.660  1.00  0.00           H  
HETATM   51  H   UNL     1      -7.024   4.902  -1.003  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.723   5.427  -0.375  1.00  0.00           H  
HETATM   53  H   UNL     1      -3.748   4.142   0.378  1.00  0.00           H  
HETATM   54  H   UNL     1      -4.223   4.012  -1.332  1.00  0.00           H  
HETATM   55  H   UNL     1      -7.166   3.583   1.744  1.00  0.00           H  
HETATM   56  H   UNL     1      -5.467   3.892   2.174  1.00  0.00           H  
HETATM   57  H   UNL     1      -6.442   5.176   1.421  1.00  0.00           H  
HETATM   58  H   UNL     1      -3.495   2.362   0.627  1.00  0.00           H  
HETATM   59  H   UNL     1      -2.221   0.302   1.395  1.00  0.00           H  
HETATM   60  H   UNL     1      -1.565  -3.828  -0.153  1.00  0.00           H  
HETATM   61  H   UNL     1      -0.510  -2.890  -1.242  1.00  0.00           H  
HETATM   62  H   UNL     1       0.828  -4.658  -0.257  1.00  0.00           H  
HETATM   63  H   UNL     1       0.262  -4.244   1.376  1.00  0.00           H  
HETATM   64  H   UNL     1       3.081  -4.448   0.722  1.00  0.00           H  
HETATM   65  H   UNL     1       6.159  -1.125  -3.285  1.00  0.00           H  
HETATM   66  H   UNL     1       9.049   0.624   1.682  1.00  0.00           H  
HETATM   67  H   UNL     1       8.822   2.302   2.227  1.00  0.00           H  
HETATM   68  H   UNL     1       9.140   2.030  -1.863  1.00  0.00           H  
CONECT    1    2    2    5   36                                       
CONECT    2    1    1    3   33                                       
CONECT    3    2   34   34   40                                       
CONECT    4   37   38   38   39                                       
CONECT    5    1   37   41   42                                       
CONECT    6   31   31   32   43                                       
CONECT    7   29   30   30   31                                       
CONECT    8   30   32   32   44                                       
CONECT    9   10   11   28   45                                       
CONECT   10    9   30   46   47                                       
CONECT   11    9   26   27   27                                       
CONECT   12   20   20   25   48                                       
CONECT   13   18   18   20   49                                       
CONECT   14   15   50   51                                            
CONECT   15   14   16   17   18                                       
CONECT   16   15   52   53   54                                       
CONECT   17   15   55   56   57                                       
CONECT   18   13   13   15   19                                       
CONECT   19   18   25   25   58                                       
CONECT   20   12   12   13   21                                       
CONECT   21   20   22   23   24                                       
CONECT   22   21                                                      
CONECT   23   21                                                      
CONECT   24   21                                                      
CONECT   25   12   19   19   26                                       
CONECT   26   11   25   59                                            
CONECT   27   11   11                                                 
CONECT   28    9   29   60   61                                       
CONECT   29    7   28   62   63                                       
CONECT   30    7    7    8   10                                       
CONECT   31    6    6    7   64                                       
CONECT   32    6    8    8   33                                       
CONECT   33    2   32                                                 
CONECT   34    3    3   35   65                                       
CONECT   35   34   36   36                                            
CONECT   36    1   35   35   39                                       
CONECT   37    4    5   66   67                                       
CONECT   38    4    4                                                 
CONECT   39    4   36   68                                            
CONECT   40    3                                                      
CONECT   41    5                                                      
CONECT   42    5                                                      
CONECT   43    6                                                      
CONECT   44    8                                                      
CONECT   45    9                                                      
CONECT   46   10                                                      
CONECT   47   10                                                      
CONECT   48   12                                                      
CONECT   49   13                                                      
CONECT   50   14                                                      
CONECT   51   14                                                      
CONECT   52   16                                                      
CONECT   53   16                                                      
CONECT   54   16                                                      
CONECT   55   17                                                      
CONECT   56   17                                                      
CONECT   57   17                                                      
CONECT   58   19                                                      
CONECT   59   26                                                      
CONECT   60   28                                                      
CONECT   61   28                                                      
CONECT   62   29                                                      
CONECT   63   29                                                      
CONECT   64   31                                                      
CONECT   65   34                                                      
CONECT   66   37                                                      
CONECT   67   37                                                      
CONECT   68   39                                                      
MASTER        0    0    0    0    0    0    0    0   68    0   68    0
END
