COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.065   0.833  -0.234  1.00  0.00           C  
HETATM    2  C   UNL     1       4.676   0.943  -0.031  1.00  0.00           C  
HETATM    3  C   UNL     1       4.122   2.224   0.132  1.00  0.00           C  
HETATM    4  N   UNL     1       4.936   3.274   0.087  1.00  0.00           N  
HETATM    5  N   UNL     1       6.797   1.946  -0.263  1.00  0.00           N  
HETATM    6  C   UNL     1       8.027  -2.004   0.577  1.00  0.00           C  
HETATM    7  C   UNL     1       7.674  -1.066  -0.579  1.00  0.00           C  
HETATM    8  C   UNL     1       7.679  -1.850  -1.892  1.00  0.00           C  
HETATM    9  N   UNL     1       6.343  -0.496  -0.356  1.00  0.00           N  
HETATM   10  N   UNL     1       5.159  -1.232  -0.234  1.00  0.00           N  
HETATM   11  C   UNL     1       6.234   3.124  -0.105  1.00  0.00           C  
HETATM   12  N   UNL     1       2.765   2.387   0.334  1.00  0.00           N  
HETATM   13  C   UNL     1       4.146  -0.419  -0.046  1.00  0.00           C  
HETATM   14  C   UNL     1       2.727  -0.811   0.129  1.00  0.00           C  
HETATM   15  C   UNL     1       1.722  -0.111  -0.537  1.00  0.00           C  
HETATM   16  C   UNL     1       0.403  -0.477  -0.373  1.00  0.00           C  
HETATM   17  C   UNL     1       2.395  -1.884   0.955  1.00  0.00           C  
HETATM   18  C   UNL     1       1.075  -2.247   1.116  1.00  0.00           C  
HETATM   19  C   UNL     1       0.075  -1.544   0.455  1.00  0.00           C  
HETATM   20  N   UNL     1      -1.264  -1.913   0.621  1.00  0.00           N  
HETATM   21  C   UNL     1      -2.225  -0.968   0.651  1.00  0.00           C  
HETATM   22  O   UNL     1      -1.921   0.209   0.627  1.00  0.00           O  
HETATM   23  N   UNL     1      -3.522  -1.328   0.707  1.00  0.00           N  
HETATM   24  C   UNL     1      -4.523  -0.352   0.645  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.708  -0.612  -0.029  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.334   0.878   1.263  1.00  0.00           C  
HETATM   27  C   UNL     1      -5.323   1.839   1.201  1.00  0.00           C  
HETATM   28  C   UNL     1      -6.501   1.579   0.524  1.00  0.00           C  
HETATM   29  C   UNL     1      -6.694   0.354  -0.088  1.00  0.00           C  
HETATM   30  C   UNL     1      -7.981   0.072  -0.820  1.00  0.00           C  
HETATM   31  F   UNL     1      -8.908  -0.487   0.065  1.00  0.00           F  
HETATM   32  F   UNL     1      -8.493   1.267  -1.339  1.00  0.00           F  
HETATM   33  F   UNL     1      -7.736  -0.824  -1.866  1.00  0.00           F  
HETATM   34  H   UNL     1       7.293  -2.807   0.631  1.00  0.00           H  
HETATM   35  H   UNL     1       9.018  -2.428   0.411  1.00  0.00           H  
HETATM   36  H   UNL     1       8.023  -1.445   1.513  1.00  0.00           H  
HETATM   37  H   UNL     1       8.408  -0.262  -0.632  1.00  0.00           H  
HETATM   38  H   UNL     1       6.945  -2.654  -1.839  1.00  0.00           H  
HETATM   39  H   UNL     1       7.428  -1.182  -2.716  1.00  0.00           H  
HETATM   40  H   UNL     1       8.670  -2.274  -2.058  1.00  0.00           H  
HETATM   41  H   UNL     1       6.858   4.004  -0.135  1.00  0.00           H  
HETATM   42  H   UNL     1       2.216   1.625   0.576  1.00  0.00           H  
HETATM   43  H   UNL     1       2.362   3.263   0.233  1.00  0.00           H  
HETATM   44  H   UNL     1       1.976   0.719  -1.181  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.376   0.065  -0.889  1.00  0.00           H  
HETATM   46  H   UNL     1       3.172  -2.431   1.469  1.00  0.00           H  
HETATM   47  H   UNL     1       0.818  -3.078   1.756  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.501  -2.849   0.714  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.763  -2.264   0.790  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.859  -1.569  -0.507  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.415   1.081   1.793  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.177   2.795   1.681  1.00  0.00           H  
HETATM   53  H   UNL     1      -7.273   2.332   0.477  1.00  0.00           H  
CONECT    1    9    5    5    2                                       
CONECT    2    1   13    3    3                                       
CONECT    3    2    2    4   12                                       
CONECT    4    3   11   11                                            
CONECT    5    1    1   11                                            
CONECT    6    7   34   35   36                                       
CONECT    7    6    8    9   37                                       
CONECT    8    7   38   39   40                                       
CONECT    9    1    7   10                                            
CONECT   10    9   13   13                                            
CONECT   11    4    4    5   41                                       
CONECT   12    3   42   43                                            
CONECT   13    2   10   10   14                                       
CONECT   14   13   17   17   15                                       
CONECT   15   14   16   16   44                                       
CONECT   16   15   15   19   45                                       
CONECT   17   14   14   18   46                                       
CONECT   18   17   19   19   47                                       
CONECT   19   16   18   18   20                                       
CONECT   20   19   21   48                                            
CONECT   21   20   22   22   23                                       
CONECT   22   21   21                                                 
CONECT   23   21   24   49                                            
CONECT   24   23   25   25   26                                       
CONECT   25   24   24   29   50                                       
CONECT   26   24   27   27   51                                       
CONECT   27   26   26   28   52                                       
CONECT   28   27   29   29   53                                       
CONECT   29   25   28   28   30                                       
CONECT   30   29   32   33   31                                       
CONECT   31   30                                                      
CONECT   32   30                                                      
CONECT   33   30                                                      
CONECT   34    6                                                      
CONECT   35    6                                                      
CONECT   36    6                                                      
CONECT   37    7                                                      
CONECT   38    8                                                      
CONECT   39    8                                                      
CONECT   40    8                                                      
CONECT   41   11                                                      
CONECT   42   12                                                      
CONECT   43   12                                                      
CONECT   44   15                                                      
CONECT   45   16                                                      
CONECT   46   17                                                      
CONECT   47   18                                                      
CONECT   48   20                                                      
CONECT   49   23                                                      
CONECT   50   25                                                      
CONECT   51   26                                                      
CONECT   52   27                                                      
CONECT   53   28                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
