COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  F   UNL     1      -4.207   1.895  -1.045  1.00  0.00           F  
HETATM    2  C   UNL     1      -5.069   1.458  -0.101  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.643   2.356   0.783  1.00  0.00           C  
HETATM    4  C   UNL     1      -6.525   1.908   1.748  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.835   0.563   1.830  1.00  0.00           C  
HETATM    6  C   UNL     1      -6.263  -0.335   0.948  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.385   0.112  -0.021  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.766  -0.866  -0.986  1.00  0.00           C  
HETATM    9  N   UNL     1      -3.405  -1.196  -0.543  1.00  0.00           N  
HETATM   10  C   UNL     1      -2.857  -2.318  -1.316  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.503  -2.728  -0.734  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.547  -1.532  -0.787  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.163  -0.362  -0.014  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.527  -0.021  -0.617  1.00  0.00           C  
HETATM   15  C   UNL     1       0.790  -1.918  -0.150  1.00  0.00           C  
HETATM   16  O   UNL     1       1.718  -0.842  -0.304  1.00  0.00           O  
HETATM   17  C   UNL     1       2.961  -1.023   0.209  1.00  0.00           C  
HETATM   18  C   UNL     1       3.929  -0.013   0.098  1.00  0.00           C  
HETATM   19  C   UNL     1       3.656   1.219  -0.542  1.00  0.00           C  
HETATM   20  N   UNL     1       2.415   1.473  -1.087  1.00  0.00           N  
HETATM   21  N   UNL     1       4.624   2.123  -0.605  1.00  0.00           N  
HETATM   22  C   UNL     1       5.825   1.891  -0.084  1.00  0.00           C  
HETATM   23  N   UNL     1       6.792   2.875  -0.182  1.00  0.00           N  
HETATM   24  N   UNL     1       6.133   0.761   0.524  1.00  0.00           N  
HETATM   25  C   UNL     1       5.221  -0.218   0.640  1.00  0.00           C  
HETATM   26  C   UNL     1       5.516  -1.429   1.278  1.00  0.00           C  
HETATM   27  C   UNL     1       4.559  -2.397   1.373  1.00  0.00           C  
HETATM   28  C   UNL     1       3.286  -2.202   0.851  1.00  0.00           C  
HETATM   29  H   UNL     1      -5.400   3.407   0.719  1.00  0.00           H  
HETATM   30  H   UNL     1      -6.972   2.608   2.438  1.00  0.00           H  
HETATM   31  H   UNL     1      -7.525   0.214   2.585  1.00  0.00           H  
HETATM   32  H   UNL     1      -6.505  -1.385   1.015  1.00  0.00           H  
HETATM   33  H   UNL     1      -5.368  -1.774  -1.018  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.727  -0.420  -1.980  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.544  -3.163  -1.267  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.729  -2.014  -2.355  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.632  -3.045   0.301  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.089  -3.550  -1.318  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.387  -1.239  -1.824  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.287  -0.642   1.032  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.507   0.505  -0.084  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.401   0.272  -1.660  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.975   0.802  -0.061  1.00  0.00           H  
HETATM   44  H   UNL     1       0.642  -2.122   0.910  1.00  0.00           H  
HETATM   45  H   UNL     1       1.182  -2.809  -0.641  1.00  0.00           H  
HETATM   46  H   UNL     1       2.126   2.388  -1.230  1.00  0.00           H  
HETATM   47  H   UNL     1       1.831   0.737  -1.326  1.00  0.00           H  
HETATM   48  H   UNL     1       6.587   3.714  -0.625  1.00  0.00           H  
HETATM   49  H   UNL     1       7.675   2.727   0.191  1.00  0.00           H  
HETATM   50  H   UNL     1       6.498  -1.596   1.694  1.00  0.00           H  
HETATM   51  H   UNL     1       4.794  -3.328   1.867  1.00  0.00           H  
HETATM   52  H   UNL     1       2.546  -2.982   0.944  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    1    3    3    7                                       
CONECT    3    2    2    4   29                                       
CONECT    4    3    5    5   30                                       
CONECT    5    4    4    6   31                                       
CONECT    6    5    7    7   32                                       
CONECT    7    2    6    6    8                                       
CONECT    8    7    9   33   34                                       
CONECT    9    8   10   14                                            
CONECT   10    9   11   35   36                                       
CONECT   11   10   12   37   38                                       
CONECT   12   11   13   15   39                                       
CONECT   13   12   14   40   41                                       
CONECT   14    9   13   42   43                                       
CONECT   15   12   16   44   45                                       
CONECT   16   15   17                                                 
CONECT   17   16   18   18   28                                       
CONECT   18   17   17   19   25                                       
CONECT   19   18   20   21   21                                       
CONECT   20   19   46   47                                            
CONECT   21   19   19   22                                            
CONECT   22   21   23   24   24                                       
CONECT   23   22   48   49                                            
CONECT   24   22   22   25                                            
CONECT   25   18   24   26   26                                       
CONECT   26   25   25   27   50                                       
CONECT   27   26   28   28   51                                       
CONECT   28   17   27   27   52                                       
CONECT   29    3                                                      
CONECT   30    4                                                      
CONECT   31    5                                                      
CONECT   32    6                                                      
CONECT   33    8                                                      
CONECT   34    8                                                      
CONECT   35   10                                                      
CONECT   36   10                                                      
CONECT   37   11                                                      
CONECT   38   11                                                      
CONECT   39   12                                                      
CONECT   40   13                                                      
CONECT   41   13                                                      
CONECT   42   14                                                      
CONECT   43   14                                                      
CONECT   44   15                                                      
CONECT   45   15                                                      
CONECT   46   20                                                      
CONECT   47   20                                                      
CONECT   48   23                                                      
CONECT   49   23                                                      
CONECT   50   26                                                      
CONECT   51   27                                                      
CONECT   52   28                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
