COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       1.759  -1.411  -0.567  1.00  0.00           N  
HETATM    2  C   UNL     1       0.881  -2.331   0.059  1.00  0.00           C  
HETATM    3  C   UNL     1       1.721  -3.440   0.536  1.00  0.00           C  
HETATM    4  C   UNL     1       2.987  -3.167   0.204  1.00  0.00           C  
HETATM    5  N   UNL     1       3.049  -1.946  -0.466  1.00  0.00           N  
HETATM    6  C   UNL     1       1.405  -0.206  -1.174  1.00  0.00           C  
HETATM    7  C   UNL     1       0.372  -0.170  -2.104  1.00  0.00           C  
HETATM    8  C   UNL     1       0.024   1.024  -2.702  1.00  0.00           C  
HETATM    9  C   UNL     1       0.702   2.185  -2.377  1.00  0.00           C  
HETATM   10  C   UNL     1       1.730   2.155  -1.452  1.00  0.00           C  
HETATM   11  C   UNL     1       2.079   0.964  -0.845  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.461  -2.214   0.191  1.00  0.00           C  
HETATM   13  C   UNL     1       2.465   3.422  -1.102  1.00  0.00           C  
HETATM   14  N   UNL     1       1.798   4.078   0.026  1.00  0.00           N  
HETATM   15  C   UNL     1       4.171  -4.048   0.508  1.00  0.00           C  
HETATM   16  F   UNL     1       3.739  -5.191   1.190  1.00  0.00           F  
HETATM   17  F   UNL     1       4.792  -4.424  -0.687  1.00  0.00           F  
HETATM   18  F   UNL     1       5.082  -3.346   1.306  1.00  0.00           F  
HETATM   19  C   UNL     1       2.284   5.236   0.516  1.00  0.00           C  
HETATM   20  C   UNL     1       1.598   5.910   1.676  1.00  0.00           C  
HETATM   21  O   UNL     1       3.272   5.736   0.022  1.00  0.00           O  
HETATM   22  N   UNL     1       2.531   6.843   2.322  1.00  0.00           N  
HETATM   23  C   UNL     1       0.377   6.680   1.169  1.00  0.00           C  
HETATM   24  N   UNL     1      -1.332  -3.168   0.698  1.00  0.00           N  
HETATM   25  N   UNL     1      -2.615  -2.605   0.640  1.00  0.00           N  
HETATM   26  C   UNL     1      -2.513  -1.410   0.138  1.00  0.00           C  
HETATM   27  O   UNL     1      -1.218  -1.136  -0.142  1.00  0.00           O  
HETATM   28  C   UNL     1      -3.641  -0.487  -0.089  1.00  0.00           C  
HETATM   29  C   UNL     1      -3.429   0.745  -0.702  1.00  0.00           C  
HETATM   30  C   UNL     1      -4.490   1.609  -0.913  1.00  0.00           C  
HETATM   31  C   UNL     1      -5.768   1.269  -0.522  1.00  0.00           C  
HETATM   32  C   UNL     1      -6.010   0.045   0.094  1.00  0.00           C  
HETATM   33  C   UNL     1      -4.944  -0.845   0.309  1.00  0.00           C  
HETATM   34  C   UNL     1      -5.521  -2.022   0.956  1.00  0.00           C  
HETATM   35  C   UNL     1      -6.839  -1.793   1.085  1.00  0.00           C  
HETATM   36  N   UNL     1      -7.148  -0.559   0.583  1.00  0.00           N  
HETATM   37  H   UNL     1       3.858  -1.533  -0.807  1.00  0.00           H  
HETATM   38  H   UNL     1       1.377  -4.318   1.062  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.157  -1.077  -2.359  1.00  0.00           H  
HETATM   40  H   UNL     1       2.879   0.942  -0.120  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.778   1.052  -3.425  1.00  0.00           H  
HETATM   42  H   UNL     1       0.427   3.119  -2.846  1.00  0.00           H  
HETATM   43  H   UNL     1       3.492   3.182  -0.827  1.00  0.00           H  
HETATM   44  H   UNL     1       2.466   4.092  -1.962  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.099  -4.051   1.028  1.00  0.00           H  
HETATM   46  H   UNL     1       1.008   3.678   0.421  1.00  0.00           H  
HETATM   47  H   UNL     1       1.279   5.157   2.397  1.00  0.00           H  
HETATM   48  H   UNL     1       2.842   7.551   1.673  1.00  0.00           H  
HETATM   49  H   UNL     1       2.117   7.260   3.141  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.316   5.988   0.690  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.119   7.168   2.008  1.00  0.00           H  
HETATM   52  H   UNL     1       0.695   7.433   0.448  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.434   1.028  -1.015  1.00  0.00           H  
HETATM   54  H   UNL     1      -4.314   2.562  -1.390  1.00  0.00           H  
HETATM   55  H   UNL     1      -6.584   1.955  -0.694  1.00  0.00           H  
HETATM   56  H   UNL     1      -8.037  -0.171   0.564  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.989  -2.908   1.271  1.00  0.00           H  
HETATM   58  H   UNL     1      -7.547  -2.478   1.528  1.00  0.00           H  
CONECT    1    2    5    6                                            
CONECT    2    1    3   12   12                                       
CONECT    3    2    4    4   38                                       
CONECT    4    3    3    5   15                                       
CONECT    5    1    4   37                                            
CONECT    6    1    7   11   11                                       
CONECT    7    6    8    8   39                                       
CONECT    8    7    7    9   41                                       
CONECT    9    8   10   10   42                                       
CONECT   10    9    9   11   13                                       
CONECT   11    6    6   10   40                                       
CONECT   12    2    2   24   27                                       
CONECT   13   10   14   43   44                                       
CONECT   14   13   19   46                                            
CONECT   15    4   16   17   18                                       
CONECT   16   15                                                      
CONECT   17   15                                                      
CONECT   18   15                                                      
CONECT   19   14   20   21   21                                       
CONECT   20   19   22   23   47                                       
CONECT   21   19   19                                                 
CONECT   22   20   48   49                                            
CONECT   23   20   50   51   52                                       
CONECT   24   12   25   45                                            
CONECT   25   24   26   26                                            
CONECT   26   25   25   27   28                                       
CONECT   27   12   26                                                 
CONECT   28   26   29   33   33                                       
CONECT   29   28   30   30   53                                       
CONECT   30   29   29   31   54                                       
CONECT   31   30   32   32   55                                       
CONECT   32   31   31   33   36                                       
CONECT   33   28   28   32   34                                       
CONECT   34   33   35   35   57                                       
CONECT   35   34   34   36   58                                       
CONECT   36   32   35   56                                            
CONECT   37    5                                                      
CONECT   38    3                                                      
CONECT   39    7                                                      
CONECT   40   11                                                      
CONECT   41    8                                                      
CONECT   42    9                                                      
CONECT   43   13                                                      
CONECT   44   13                                                      
CONECT   45   24                                                      
CONECT   46   14                                                      
CONECT   47   20                                                      
CONECT   48   22                                                      
CONECT   49   22                                                      
CONECT   50   23                                                      
CONECT   51   23                                                      
CONECT   52   23                                                      
CONECT   53   29                                                      
CONECT   54   30                                                      
CONECT   55   31                                                      
CONECT   56   36                                                      
CONECT   57   34                                                      
CONECT   58   35                                                      
MASTER        0    0    0    0    0    0    0    0   58    0   58    0
END
