COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -5.494   0.384   0.464  1.00  0.00           N  
HETATM    2  C   UNL     1      -5.497   0.504  -0.876  1.00  0.00           C  
HETATM    3  O   UNL     1      -4.826  -0.256  -1.547  1.00  0.00           O  
HETATM    4  N   UNL     1      -6.232   1.454  -1.484  1.00  0.00           N  
HETATM    5  C   UNL     1      -6.982   2.304  -0.754  1.00  0.00           C  
HETATM    6  O   UNL     1      -7.647   3.164  -1.303  1.00  0.00           O  
HETATM    7  C   UNL     1      -6.988   2.189   0.657  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.241   1.227   1.241  1.00  0.00           C  
HETATM    9  P   UNL     1       0.929  -1.263  -0.512  1.00  0.00           P  
HETATM   10  P   UNL     1       3.669  -0.112  -0.330  1.00  0.00           P  
HETATM   11  P   UNL     1       6.408   1.038  -0.148  1.00  0.00           P  
HETATM   12  C   UNL     1      -4.689  -0.663   1.097  1.00  0.00           C  
HETATM   13  F   UNL     1       1.498   1.053   0.624  1.00  0.00           F  
HETATM   14  O   UNL     1       0.763  -0.656  -1.851  1.00  0.00           O  
HETATM   15  F   UNL     1       4.238   2.204   0.806  1.00  0.00           F  
HETATM   16  O   UNL     1       3.503   0.495  -1.669  1.00  0.00           O  
HETATM   17  O   UNL     1       7.394   1.953   0.737  1.00  0.00           O  
HETATM   18  C   UNL     1      -5.228  -2.051   0.700  1.00  0.00           C  
HETATM   19  F   UNL     1       2.202  -0.802   1.757  1.00  0.00           F  
HETATM   20  O   UNL     1       1.559  -2.737  -0.666  1.00  0.00           O  
HETATM   21  F   UNL     1       4.942   0.349   1.939  1.00  0.00           F  
HETATM   22  O   UNL     1       4.298  -1.586  -0.484  1.00  0.00           O  
HETATM   23  O   UNL     1       6.987  -0.317  -0.290  1.00  0.00           O  
HETATM   24  C   UNL     1      -4.023  -2.746   0.020  1.00  0.00           C  
HETATM   25  O   UNL     1      -3.937  -4.117   0.414  1.00  0.00           O  
HETATM   26  C   UNL     1       2.045  -0.228   0.491  1.00  0.00           C  
HETATM   27  C   UNL     1       4.785   0.923   0.673  1.00  0.00           C  
HETATM   28  O   UNL     1       6.227   1.699  -1.605  1.00  0.00           O  
HETATM   29  C   UNL     1      -2.825  -1.935   0.575  1.00  0.00           C  
HETATM   30  O   UNL     1      -3.331  -0.584   0.632  1.00  0.00           O  
HETATM   31  C   UNL     1      -1.629  -2.022  -0.375  1.00  0.00           C  
HETATM   32  O   UNL     1      -0.505  -1.365   0.213  1.00  0.00           O  
HETATM   33  C   UNL     1      -7.817   3.127   1.496  1.00  0.00           C  
HETATM   34  H   UNL     1      -6.222   1.527  -2.451  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.234   1.124   2.316  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.719  -0.550   2.181  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.540  -2.607   1.584  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.057  -1.952  -0.001  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.085  -2.658  -1.064  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.708  -4.646   0.168  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.552  -2.285   1.571  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.385  -3.069  -0.556  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.879  -1.539  -1.320  1.00  0.00           H  
HETATM   44  H   UNL     1      -8.343   3.826   0.847  1.00  0.00           H  
HETATM   45  H   UNL     1      -8.541   2.553   2.075  1.00  0.00           H  
HETATM   46  H   UNL     1      -7.166   3.680   2.174  1.00  0.00           H  
HETATM   47  H   UNL     1       4.435  -2.045   0.356  1.00  0.00           H  
HETATM   48  H   UNL     1       5.852   2.590  -1.589  1.00  0.00           H  
HETATM   49  H   UNL     1       8.278   2.058   0.360  1.00  0.00           H  
HETATM   50  H   UNL     1       1.696  -3.196   0.174  1.00  0.00           H  
CONECT    1    2    8   12                                            
CONECT    2    1    3    3    4                                       
CONECT    3    2    2                                                 
CONECT    4    2    5   34                                            
CONECT    5    4    6    6    7                                       
CONECT    6    5    5                                                 
CONECT    7    5    8    8   33                                       
CONECT    8    1    7    7   35                                       
CONECT    9   14   14   20   26                                       
CONECT    9   32                                                      
CONECT   10   16   16   22   26                                       
CONECT   10   27                                                      
CONECT   11   17   23   23   27                                       
CONECT   11   28                                                      
CONECT   12    1   18   30   36                                       
CONECT   13   26                                                      
CONECT   14    9    9                                                 
CONECT   15   27                                                      
CONECT   16   10   10                                                 
CONECT   17   11   49                                                 
CONECT   18   12   24   37   38                                       
CONECT   19   26                                                      
CONECT   20    9   50                                                 
CONECT   21   27                                                      
CONECT   22   10   47                                                 
CONECT   23   11   11                                                 
CONECT   24   18   25   29   39                                       
CONECT   25   24   40                                                 
CONECT   26    9   10   13   19                                       
CONECT   27   10   11   15   21                                       
CONECT   28   11   48                                                 
CONECT   29   24   30   31   41                                       
CONECT   30   12   29                                                 
CONECT   31   29   32   42   43                                       
CONECT   32    9   31                                                 
CONECT   33    7   44   45   46                                       
CONECT   34    4                                                      
CONECT   35    8                                                      
CONECT   36   12                                                      
CONECT   37   18                                                      
CONECT   38   18                                                      
CONECT   39   24                                                      
CONECT   40   25                                                      
CONECT   41   29                                                      
CONECT   42   31                                                      
CONECT   43   31                                                      
CONECT   44   33                                                      
CONECT   45   33                                                      
CONECT   46   33                                                      
CONECT   47   22                                                      
CONECT   48   28                                                      
CONECT   49   17                                                      
CONECT   50   20                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
