COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -5.017  -4.055   0.132  1.00  0.00           O  
HETATM    2  C   UNL     1      -3.552   3.450  -0.925  1.00  0.00           C  
HETATM    3  N   UNL     1       2.831   2.093   0.195  1.00  0.00           N  
HETATM    4  C   UNL     1       2.064   2.711   1.286  1.00  0.00           C  
HETATM    5  C   UNL     1       3.843   1.245   0.463  1.00  0.00           C  
HETATM    6  C   UNL     1       0.575   2.437   1.058  1.00  0.00           C  
HETATM    7  C   UNL     1       0.179   2.918  -0.340  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.017   1.175  -0.180  1.00  0.00           C  
HETATM    9  C   UNL     1       4.620   0.619  -0.666  1.00  0.00           C  
HETATM   10  C   UNL     1       5.363  -1.546   0.106  1.00  0.00           C  
HETATM   11  C   UNL     1       6.382  -2.495   0.679  1.00  0.00           C  
HETATM   12  C   UNL     1       8.835  -2.924   0.936  1.00  0.00           C  
HETATM   13  N   UNL     1       5.659  -0.257  -0.118  1.00  0.00           N  
HETATM   14  C   UNL     1       7.785  -2.036   0.265  1.00  0.00           C  
HETATM   15  C   UNL     1       7.928  -2.130  -1.255  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.370  -1.709   0.296  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.882  -0.421   0.223  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.541  -0.200  -0.101  1.00  0.00           C  
HETATM   19  N   UNL     1      -1.253   2.687  -0.548  1.00  0.00           N  
HETATM   20  O   UNL     1       4.254  -1.957  -0.163  1.00  0.00           O  
HETATM   21  O   UNL     1       4.129   0.985   1.613  1.00  0.00           O  
HETATM   22  C   UNL     1      -4.531  -2.787   0.054  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.387   4.698  -0.705  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.448   5.064   0.748  1.00  0.00           C  
HETATM   25  C   UNL     1      -1.013  -3.342  -0.831  1.00  0.00           C  
HETATM   26  C   UNL     1      -3.193  -2.575  -0.269  1.00  0.00           C  
HETATM   27  C   UNL     1      -6.398  -4.201   0.468  1.00  0.00           C  
HETATM   28  C   UNL     1      -4.113   4.260   1.704  1.00  0.00           C  
HETATM   29  C   UNL     1      -3.601   2.870   1.499  1.00  0.00           C  
HETATM   30  C   UNL     1      -3.926   2.360   0.089  1.00  0.00           C  
HETATM   31  C   UNL     1      -2.698  -1.286  -0.349  1.00  0.00           C  
HETATM   32  N   UNL     1      -1.773   1.388  -0.479  1.00  0.00           N  
HETATM   33  F   UNL     1      -6.636  -3.629   1.722  1.00  0.00           F  
HETATM   34  F   UNL     1      -7.183  -3.556  -0.495  1.00  0.00           F  
HETATM   35  O   UNL     1      -2.374  -3.634  -0.505  1.00  0.00           O  
HETATM   36  F   UNL     1      -0.968  -2.566  -1.993  1.00  0.00           F  
HETATM   37  F   UNL     1      -0.422  -2.638   0.224  1.00  0.00           F  
HETATM   38  C   UNL     1      -2.078   3.728  -0.808  1.00  0.00           C  
HETATM   39  O   UNL     1      -1.642   4.852  -0.942  1.00  0.00           O  
HETATM   40  C   UNL     1       0.979   2.146  -1.392  1.00  0.00           C  
HETATM   41  C   UNL     1       2.469   2.413  -1.192  1.00  0.00           C  
HETATM   42  C   UNL     1       6.869   0.261   0.140  1.00  0.00           C  
HETATM   43  O   UNL     1       7.076   1.433  -0.094  1.00  0.00           O  
HETATM   44  C   UNL     1       7.975  -0.583   0.715  1.00  0.00           C  
HETATM   45  H   UNL     1      -3.745   3.073  -1.930  1.00  0.00           H  
HETATM   46  H   UNL     1       2.374   2.282   2.239  1.00  0.00           H  
HETATM   47  H   UNL     1       2.241   3.787   1.292  1.00  0.00           H  
HETATM   48  H   UNL     1       0.385   1.367   1.142  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.012   2.970   1.806  1.00  0.00           H  
HETATM   50  H   UNL     1       0.392   3.983  -0.431  1.00  0.00           H  
HETATM   51  H   UNL     1       3.945   0.034  -1.292  1.00  0.00           H  
HETATM   52  H   UNL     1       5.085   1.402  -1.266  1.00  0.00           H  
HETATM   53  H   UNL     1       6.306  -2.498   1.766  1.00  0.00           H  
HETATM   54  H   UNL     1       6.200  -3.499   0.297  1.00  0.00           H  
HETATM   55  H   UNL     1       8.686  -3.958   0.627  1.00  0.00           H  
HETATM   56  H   UNL     1       9.831  -2.595   0.640  1.00  0.00           H  
HETATM   57  H   UNL     1       8.734  -2.849   2.019  1.00  0.00           H  
HETATM   58  H   UNL     1       7.183  -1.492  -1.731  1.00  0.00           H  
HETATM   59  H   UNL     1       8.926  -1.803  -1.547  1.00  0.00           H  
HETATM   60  H   UNL     1       7.777  -3.162  -1.571  1.00  0.00           H  
HETATM   61  H   UNL     1      -6.407  -1.879   0.546  1.00  0.00           H  
HETATM   62  H   UNL     1      -5.536   0.416   0.416  1.00  0.00           H  
HETATM   63  H   UNL     1      -3.947   5.525  -1.262  1.00  0.00           H  
HETATM   64  H   UNL     1      -5.398   4.521  -1.071  1.00  0.00           H  
HETATM   65  H   UNL     1      -4.791   6.054   1.010  1.00  0.00           H  
HETATM   66  H   UNL     1      -0.471  -4.273  -0.995  1.00  0.00           H  
HETATM   67  H   UNL     1      -6.655  -5.260   0.496  1.00  0.00           H  
HETATM   68  H   UNL     1      -4.209   4.617   2.719  1.00  0.00           H  
HETATM   69  H   UNL     1      -2.520   2.863   1.639  1.00  0.00           H  
HETATM   70  H   UNL     1      -4.060   2.208   2.233  1.00  0.00           H  
HETATM   71  H   UNL     1      -4.975   2.080  -0.006  1.00  0.00           H  
HETATM   72  H   UNL     1      -1.660  -1.120  -0.600  1.00  0.00           H  
HETATM   73  H   UNL     1       0.785   1.079  -1.285  1.00  0.00           H  
HETATM   74  H   UNL     1       0.679   2.472  -2.388  1.00  0.00           H  
HETATM   75  H   UNL     1       2.680   3.464  -1.392  1.00  0.00           H  
HETATM   76  H   UNL     1       3.046   1.787  -1.874  1.00  0.00           H  
HETATM   77  H   UNL     1       7.945  -0.532   1.803  1.00  0.00           H  
HETATM   78  H   UNL     1       8.937  -0.215   0.359  1.00  0.00           H  
CONECT    1   22   27                                                 
CONECT    2   38   23   30   45                                       
CONECT    3   41    5    4                                            
CONECT    4    3    6   46   47                                       
CONECT    5   21   21    3    9                                       
CONECT    6    4    7   48   49                                       
CONECT    7   40    6   19   50                                       
CONECT    8   32   32   30   18                                       
CONECT    9    5   13   51   52                                       
CONECT   10   20   20   11   13                                       
CONECT   11   10   14   53   54                                       
CONECT   12   14   55   56   57                                       
CONECT   13   10    9   42                                            
CONECT   14   12   11   15   44                                       
CONECT   15   14   58   59   60                                       
CONECT   16   17   17   22   61                                       
CONECT   17   18   16   16   62                                       
CONECT   18    8   31   31   17                                       
CONECT   19    7   38   32                                            
CONECT   20   10   10                                                 
CONECT   21    5    5                                                 
CONECT   22   26   26   16    1                                       
CONECT   23    2   24   63   64                                       
CONECT   24   23   28   28   65                                       
CONECT   25   36   37   35   66                                       
CONECT   26   31   35   22   22                                       
CONECT   27    1   34   33   67                                       
CONECT   28   24   24   29   68                                       
CONECT   29   30   28   69   70                                       
CONECT   30    2    8   29   71                                       
CONECT   31   18   18   26   72                                       
CONECT   32   19    8    8                                            
CONECT   33   27                                                      
CONECT   34   27                                                      
CONECT   35   25   26                                                 
CONECT   36   25                                                      
CONECT   37   25                                                      
CONECT   38   39   39   19    2                                       
CONECT   39   38   38                                                 
CONECT   40   41    7   73   74                                       
CONECT   41    3   40   75   76                                       
CONECT   42   13   44   43   43                                       
CONECT   43   42   42                                                 
CONECT   44   14   42   77   78                                       
CONECT   45    2                                                      
CONECT   46    4                                                      
CONECT   47    4                                                      
CONECT   48    6                                                      
CONECT   49    6                                                      
CONECT   50    7                                                      
CONECT   51    9                                                      
CONECT   52    9                                                      
CONECT   53   11                                                      
CONECT   54   11                                                      
CONECT   55   12                                                      
CONECT   56   12                                                      
CONECT   57   12                                                      
CONECT   58   15                                                      
CONECT   59   15                                                      
CONECT   60   15                                                      
CONECT   61   16                                                      
CONECT   62   17                                                      
CONECT   63   23                                                      
CONECT   64   23                                                      
CONECT   65   24                                                      
CONECT   66   25                                                      
CONECT   67   27                                                      
CONECT   68   28                                                      
CONECT   69   29                                                      
CONECT   70   29                                                      
CONECT   71   30                                                      
CONECT   72   31                                                      
CONECT   73   40                                                      
CONECT   74   40                                                      
CONECT   75   41                                                      
CONECT   76   41                                                      
CONECT   77   44                                                      
CONECT   78   44                                                      
MASTER        0    0    0    0    0    0    0    0   78    0   78    0
END
