COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -1.090   1.092  -0.238  1.00  0.00           N  
HETATM    2  N   UNL     1       2.538   0.650  -0.771  1.00  0.00           N  
HETATM    3  C   UNL     1      -0.691   3.453  -0.237  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.134   3.477  -1.704  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.300   2.571  -2.104  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.056   4.815  -2.442  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.166   2.279   0.646  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.125  -0.012   0.632  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.251  -2.183   1.506  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.504  -0.480   0.386  1.00  0.00           C  
HETATM   11  C   UNL     1       3.701   0.282   0.039  1.00  0.00           C  
HETATM   12  C   UNL     1       7.742   0.095   1.804  1.00  0.00           C  
HETATM   13  C   UNL     1       4.600  -0.664  -0.760  1.00  0.00           C  
HETATM   14  C   UNL     1       3.831  -1.946  -1.084  1.00  0.00           C  
HETATM   15  C   UNL     1       3.630  -4.177  -0.229  1.00  0.00           C  
HETATM   16  O   UNL     1       1.256   0.836   1.031  1.00  0.00           O  
HETATM   17  C   UNL     1       1.356   0.909  -0.176  1.00  0.00           C  
HETATM   18  C   UNL     1       0.160   1.288  -1.009  1.00  0.00           C  
HETATM   19  C   UNL     1       0.185   2.798  -1.332  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.959   0.065  -0.319  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.709  -0.775   1.891  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.559  -0.035   2.578  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.899  -0.869   2.847  1.00  0.00           C  
HETATM   24  N   UNL     1      -4.238  -0.710  -0.016  1.00  0.00           N  
HETATM   25  C   UNL     1      -6.649  -1.199  -0.281  1.00  0.00           C  
HETATM   26  F   UNL     1      -7.855  -0.798   0.304  1.00  0.00           F  
HETATM   27  F   UNL     1      -6.665  -0.886  -1.645  1.00  0.00           F  
HETATM   28  F   UNL     1      -6.489  -2.580  -0.122  1.00  0.00           F  
HETATM   29  O   UNL     1      -5.722   0.305   1.284  1.00  0.00           O  
HETATM   30  O   UNL     1      -1.801  -0.799  -1.156  1.00  0.00           O  
HETATM   31  C   UNL     1       4.486   1.542   0.408  1.00  0.00           C  
HETATM   32  O   UNL     1       3.614   2.476   1.047  1.00  0.00           O  
HETATM   33  C   UNL     1       5.608   1.178   1.347  1.00  0.00           C  
HETATM   34  N   UNL     1       6.703   0.550   0.877  1.00  0.00           N  
HETATM   35  O   UNL     1       5.524   1.451   2.526  1.00  0.00           O  
HETATM   36  C   UNL     1       3.473  -2.706   0.214  1.00  0.00           C  
HETATM   37  N   UNL     1       4.582  -4.151  -1.345  1.00  0.00           N  
HETATM   38  C   UNL     1       4.710  -2.911  -1.849  1.00  0.00           C  
HETATM   39  O   UNL     1       5.426  -2.611  -2.780  1.00  0.00           O  
HETATM   40  H   UNL     1       2.618   0.709  -1.736  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.392   4.373   0.264  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.166   3.182  -2.355  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.015   1.972  -2.970  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.549   1.911  -1.273  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.537   5.544  -1.820  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.513   4.683  -3.378  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.064   5.172  -2.655  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.191   2.442   0.976  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.504   2.156   1.503  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.439   0.996   0.904  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.403  -2.115   0.824  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.954  -2.726   2.403  1.00  0.00           H  
HETATM   53  H   UNL     1      -3.069  -2.710   1.016  1.00  0.00           H  
HETATM   54  H   UNL     1       3.367  -0.217   0.949  1.00  0.00           H  
HETATM   55  H   UNL     1       8.142   0.951   2.349  1.00  0.00           H  
HETATM   56  H   UNL     1       7.313  -0.616   2.510  1.00  0.00           H  
HETATM   57  H   UNL     1       8.543  -0.386   1.244  1.00  0.00           H  
HETATM   58  H   UNL     1       4.905  -0.178  -1.687  1.00  0.00           H  
HETATM   59  H   UNL     1       5.484  -0.909  -0.171  1.00  0.00           H  
HETATM   60  H   UNL     1       2.930  -1.716  -1.653  1.00  0.00           H  
HETATM   61  H   UNL     1       4.026  -4.778   0.591  1.00  0.00           H  
HETATM   62  H   UNL     1       2.671  -4.576  -0.558  1.00  0.00           H  
HETATM   63  H   UNL     1       0.136   0.702  -1.928  1.00  0.00           H  
HETATM   64  H   UNL     1       1.128   3.241  -1.655  1.00  0.00           H  
HETATM   65  H   UNL     1      -1.895   0.958   2.878  1.00  0.00           H  
HETATM   66  H   UNL     1      -1.243  -0.593   3.459  1.00  0.00           H  
HETATM   67  H   UNL     1      -0.722   0.058   1.887  1.00  0.00           H  
HETATM   68  H   UNL     1      -4.718  -1.396   2.358  1.00  0.00           H  
HETATM   69  H   UNL     1      -3.602  -1.412   3.744  1.00  0.00           H  
HETATM   70  H   UNL     1      -4.225   0.134   3.122  1.00  0.00           H  
HETATM   71  H   UNL     1      -4.064  -1.338  -0.735  1.00  0.00           H  
HETATM   72  H   UNL     1       4.899   1.990  -0.495  1.00  0.00           H  
HETATM   73  H   UNL     1       2.867   2.755   0.500  1.00  0.00           H  
HETATM   74  H   UNL     1       6.804   0.399  -0.076  1.00  0.00           H  
HETATM   75  H   UNL     1       4.173  -2.462   1.014  1.00  0.00           H  
HETATM   76  H   UNL     1       2.447  -2.497   0.518  1.00  0.00           H  
HETATM   77  H   UNL     1       5.057  -4.929  -1.677  1.00  0.00           H  
CONECT    1   18    7   20                                            
CONECT    2   11   17   40                                            
CONECT    3   19    4    7   41                                       
CONECT    4    6   19    3    5                                       
CONECT    5    4   42   43   44                                       
CONECT    6    4   45   46   47                                       
CONECT    7    3    1   48   49                                       
CONECT    8   20   21   24   50                                       
CONECT    9   21   51   52   53                                       
CONECT   10   24   29   29   25                                       
CONECT   11   31    2   13   54                                       
CONECT   12   34   55   56   57                                       
CONECT   13   11   14   58   59                                       
CONECT   14   13   36   38   60                                       
CONECT   15   36   37   61   62                                       
CONECT   16   17   17                                                 
CONECT   17    2   16   16   18                                       
CONECT   18   19   17    1   63                                       
CONECT   19    4    3   18   64                                       
CONECT   20    1   30   30    8                                       
CONECT   21    9    8   22   23                                       
CONECT   22   21   65   66   67                                       
CONECT   23   21   68   69   70                                       
CONECT   24    8   10   71                                            
CONECT   25   10   27   28   26                                       
CONECT   26   25                                                      
CONECT   27   25                                                      
CONECT   28   25                                                      
CONECT   29   10   10                                                 
CONECT   30   20   20                                                 
CONECT   31   33   32   11   72                                       
CONECT   32   31   73                                                 
CONECT   33   34   35   35   31                                       
CONECT   34   12   33   74                                            
CONECT   35   33   33                                                 
CONECT   36   14   15   75   76                                       
CONECT   37   38   15   77                                            
CONECT   38   14   39   39   37                                       
CONECT   39   38   38                                                 
CONECT   40    2                                                      
CONECT   41    3                                                      
CONECT   42    5                                                      
CONECT   43    5                                                      
CONECT   44    5                                                      
CONECT   45    6                                                      
CONECT   46    6                                                      
CONECT   47    6                                                      
CONECT   48    7                                                      
CONECT   49    7                                                      
CONECT   50    8                                                      
CONECT   51    9                                                      
CONECT   52    9                                                      
CONECT   53    9                                                      
CONECT   54   11                                                      
CONECT   55   12                                                      
CONECT   56   12                                                      
CONECT   57   12                                                      
CONECT   58   13                                                      
CONECT   59   13                                                      
CONECT   60   14                                                      
CONECT   61   15                                                      
CONECT   62   15                                                      
CONECT   63   18                                                      
CONECT   64   19                                                      
CONECT   65   22                                                      
CONECT   66   22                                                      
CONECT   67   22                                                      
CONECT   68   23                                                      
CONECT   69   23                                                      
CONECT   70   23                                                      
CONECT   71   24                                                      
CONECT   72   31                                                      
CONECT   73   32                                                      
CONECT   74   34                                                      
CONECT   75   36                                                      
CONECT   76   36                                                      
CONECT   77   37                                                      
MASTER        0    0    0    0    0    0    0    0   77    0   77    0
END
