COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1 FE   UNL     1      10.854  20.275  36.289  1.00  0.00          Fe  
HETATM    2  C   UNL     1      11.459  23.327  34.931  1.00  0.00           C  
HETATM    3  C   UNL     1       7.482  20.798  35.893  1.00  0.00           C  
HETATM    4  C   UNL     1      10.323  17.713  38.211  1.00  0.00           C  
HETATM    5  C   UNL     1      14.142  19.600  36.214  1.00  0.00           C  
HETATM    6  N   UNL     1       9.733  21.753  35.522  1.00  0.00           N  
HETATM    7  C   UNL     1      10.138  22.932  34.986  1.00  0.00           C  
HETATM    8  C   UNL     1       8.974  23.786  34.716  1.00  0.00           C  
HETATM    9  C   UNL     1       7.840  23.102  35.042  1.00  0.00           C  
HETATM   10  C   UNL     1       8.334  21.786  35.453  1.00  0.00           C  
HETATM   11  C   UNL     1       6.370  23.507  34.849  1.00  0.00           C  
HETATM   12  C   UNL     1       9.069  25.213  34.166  1.00  0.00           C  
HETATM   13  C   UNL     1       8.925  26.228  35.315  1.00  0.00           C  
HETATM   14  C   UNL     1       8.847  27.662  34.817  1.00  0.00           C  
HETATM   15  O   UNL     1       9.550  27.963  33.829  1.00  0.00           O  
HETATM   16  O   UNL     1       8.083  28.459  35.436  1.00  0.00           O  
HETATM   17  N   UNL     1       9.258  19.438  36.945  1.00  0.00           N  
HETATM   18  C   UNL     1       7.915  19.684  36.650  1.00  0.00           C  
HETATM   19  C   UNL     1       7.015  18.643  37.134  1.00  0.00           C  
HETATM   20  C   UNL     1       7.827  17.904  38.044  1.00  0.00           C  
HETATM   21  C   UNL     1       9.193  18.406  37.890  1.00  0.00           C  
HETATM   22  C   UNL     1       5.530  18.648  36.926  1.00  0.00           C  
HETATM   23  C   UNL     1      13.419  16.103  40.457  1.00  0.00           C  
HETATM   24  C   UNL     1       7.387  16.732  38.732  1.00  0.00           C  
HETATM   25  C   UNL     1       7.939  16.078  39.768  1.00  0.00           C  
HETATM   26  N   UNL     1      12.070  18.994  37.145  1.00  0.00           N  
HETATM   27  C   UNL     1      11.658  17.952  37.854  1.00  0.00           C  
HETATM   28  C   UNL     1      12.811  17.164  38.436  1.00  0.00           C  
HETATM   29  C   UNL     1      13.875  17.622  37.841  1.00  0.00           C  
HETATM   30  C   UNL     1      13.368  18.781  36.977  1.00  0.00           C  
HETATM   31  C   UNL     1      12.656  15.925  39.350  1.00  0.00           C  
HETATM   32  C   UNL     1       4.712  18.519  38.007  1.00  0.00           C  
HETATM   33  C   UNL     1      15.145  17.070  37.824  1.00  0.00           C  
HETATM   34  C   UNL     1      15.190  16.145  36.856  1.00  0.00           C  
HETATM   35  N   UNL     1      12.428  21.242  35.650  1.00  0.00           N  
HETATM   36  C   UNL     1      13.792  20.845  35.759  1.00  0.00           C  
HETATM   37  C   UNL     1      14.663  21.740  35.082  1.00  0.00           C  
HETATM   38  C   UNL     1      13.886  22.814  34.766  1.00  0.00           C  
HETATM   39  C   UNL     1      12.509  22.532  35.172  1.00  0.00           C  
HETATM   40  C   UNL     1      16.141  21.532  34.767  1.00  0.00           C  
HETATM   41  C   UNL     1      14.349  24.079  34.029  1.00  0.00           C  
HETATM   42  C   UNL     1      14.641  23.922  32.580  1.00  0.00           C  
HETATM   43  C   UNL     1      14.081  25.055  31.844  1.00  0.00           C  
HETATM   44  O   UNL     1      12.891  24.954  31.525  1.00  0.00           O  
HETATM   45  O   UNL     1      14.851  25.996  31.660  1.00  0.00           O  
HETATM   46  H   UNL     1      11.661  24.356  34.674  1.00  0.00           H  
HETATM   47  H   UNL     1       6.433  20.877  35.649  1.00  0.00           H  
HETATM   48  H   UNL     1      10.165  16.847  38.836  1.00  0.00           H  
HETATM   49  H   UNL     1      15.122  19.236  35.942  1.00  0.00           H  
HETATM   50  H   UNL     1       5.716  22.708  35.230  1.00  0.00           H  
HETATM   51  H   UNL     1       6.171  24.438  35.400  1.00  0.00           H  
HETATM   52  H   UNL     1       6.171  23.665  33.779  1.00  0.00           H  
HETATM   53  H   UNL     1      10.045  25.351  33.677  1.00  0.00           H  
HETATM   54  H   UNL     1       8.265  25.376  33.433  1.00  0.00           H  
HETATM   55  H   UNL     1       8.007  25.999  35.876  1.00  0.00           H  
HETATM   56  H   UNL     1       9.795  26.133  35.981  1.00  0.00           H  
HETATM   57  H   UNL     1       8.128  29.318  35.033  1.00  0.00           H  
HETATM   58  H   UNL     1       5.116  18.752  35.934  1.00  0.00           H  
HETATM   59  H   UNL     1      14.000  17.006  40.573  1.00  0.00           H  
HETATM   60  H   UNL     1      13.446  15.342  41.223  1.00  0.00           H  
HETATM   61  H   UNL     1       6.467  16.305  38.362  1.00  0.00           H  
HETATM   62  H   UNL     1       7.461  15.195  40.166  1.00  0.00           H  
HETATM   63  H   UNL     1       8.861  16.435  40.203  1.00  0.00           H  
HETATM   64  H   UNL     1      12.042  15.062  39.141  1.00  0.00           H  
HETATM   65  H   UNL     1       3.640  18.520  37.876  1.00  0.00           H  
HETATM   66  H   UNL     1       5.135  18.415  38.995  1.00  0.00           H  
HETATM   67  H   UNL     1      15.960  17.339  38.479  1.00  0.00           H  
HETATM   68  H   UNL     1      16.101  15.594  36.678  1.00  0.00           H  
HETATM   69  H   UNL     1      14.315  15.951  36.254  1.00  0.00           H  
HETATM   70  H   UNL     1      16.530  22.412  34.233  1.00  0.00           H  
HETATM   71  H   UNL     1      16.700  21.396  35.705  1.00  0.00           H  
HETATM   72  H   UNL     1      16.259  20.638  34.136  1.00  0.00           H  
HETATM   73  H   UNL     1      13.558  24.837  34.132  1.00  0.00           H  
HETATM   74  H   UNL     1      15.266  24.437  34.520  1.00  0.00           H  
HETATM   75  H   UNL     1      15.730  23.888  32.427  1.00  0.00           H  
HETATM   76  H   UNL     1      14.190  22.988  32.214  1.00  0.00           H  
HETATM   77  H   UNL     1      14.394  26.696  31.208  1.00  0.00           H  
CONECT    1    6   17   26   35                                       
CONECT    2    7    7   39   46                                       
CONECT    3   10   10   18   47                                       
CONECT    4   21   21   27   48                                       
CONECT    5   30   36   36   49                                       
CONECT    6    1    7   10                                            
CONECT    7    2    2    6    8                                       
CONECT    8    7    9    9   12                                       
CONECT    9    8    8   10   11                                       
CONECT   10    3    3    6    9                                       
CONECT   11    9   50   51   52                                       
CONECT   12    8   13   53   54                                       
CONECT   13   12   14   55   56                                       
CONECT   14   13   15   15   16                                       
CONECT   15   14   14                                                 
CONECT   16   14   57                                                 
CONECT   17    1   18   18   21                                       
CONECT   18    3   17   17   19                                       
CONECT   19   18   20   20   22                                       
CONECT   20   19   19   21   24                                       
CONECT   21    4    4   17   20                                       
CONECT   22   19   32   32   58                                       
CONECT   23   59   60   31   31                                       
CONECT   24   20   25   25   61                                       
CONECT   25   24   24   62   63                                       
CONECT   26    1   27   30                                            
CONECT   27    4   26   28   28                                       
CONECT   28   27   27   29   31                                       
CONECT   29   28   30   30   33                                       
CONECT   30    5   26   29   29                                       
CONECT   31   28   23   23   64                                       
CONECT   32   22   22   65   66                                       
CONECT   33   29   34   34   67                                       
CONECT   34   33   33   68   69                                       
CONECT   35    1   36   39   39                                       
CONECT   36    5    5   35   37                                       
CONECT   37   36   38   38   40                                       
CONECT   38   37   37   39   41                                       
CONECT   39    2   35   35   38                                       
CONECT   40   37   70   71   72                                       
CONECT   41   38   42   73   74                                       
CONECT   42   41   43   75   76                                       
CONECT   43   42   44   44   45                                       
CONECT   44   43   43                                                 
CONECT   45   43   77                                                 
CONECT   46    2                                                      
CONECT   47    3                                                      
CONECT   48    4                                                      
CONECT   49    5                                                      
CONECT   50   11                                                      
CONECT   51   11                                                      
CONECT   52   11                                                      
CONECT   53   12                                                      
CONECT   54   12                                                      
CONECT   55   13                                                      
CONECT   56   13                                                      
CONECT   57   16                                                      
CONECT   58   22                                                      
CONECT   59   23                                                      
CONECT   60   23                                                      
CONECT   61   24                                                      
CONECT   62   25                                                      
CONECT   63   25                                                      
CONECT   64   31                                                      
CONECT   65   32                                                      
CONECT   66   32                                                      
CONECT   67   33                                                      
CONECT   68   34                                                      
CONECT   69   34                                                      
CONECT   70   40                                                      
CONECT   71   40                                                      
CONECT   72   40                                                      
CONECT   73   41                                                      
CONECT   74   41                                                      
CONECT   75   42                                                      
CONECT   76   42                                                      
CONECT   77   45                                                      
MASTER        0    0    0    0    0    0    0    0   77    0   77    0
END
