COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      13.771  12.863  11.793  1.00  0.00           C  
HETATM    2  C   UNL     1      14.508  13.880  12.427  1.00  0.00           C  
HETATM    3  N   UNL     1      15.484  13.641  13.326  1.00  0.00           N  
HETATM    4  C   UNL     1      15.748  12.368  13.623  1.00  0.00           C  
HETATM    5  C   UNL     1      14.996  11.322  13.044  1.00  0.00           C  
HETATM    6  C   UNL     1      13.999  11.527  12.097  1.00  0.00           C  
HETATM    7  C   UNL     1      13.277  10.453  11.501  1.00  0.00           C  
HETATM    8  C   UNL     1      13.994   9.622  10.712  1.00  0.00           C  
HETATM    9  C   UNL     1      15.278   9.789  10.353  1.00  0.00           C  
HETATM   10  C   UNL     1      15.634   8.794   9.560  1.00  0.00           C  
HETATM   11  C   UNL     1      14.583   7.998   9.341  1.00  0.00           C  
HETATM   12  N   UNL     1      13.558   8.508  10.054  1.00  0.00           N  
HETATM   13  C   UNL     1      11.944  10.371  11.762  1.00  0.00           C  
HETATM   14  N   UNL     1      11.094   9.448  11.253  1.00  0.00           N  
HETATM   15  C   UNL     1      11.203  11.193  12.516  1.00  0.00           C  
HETATM   16  C   UNL     1       9.955  10.801  12.483  1.00  0.00           C  
HETATM   17  C   UNL     1       9.846   9.696  11.726  1.00  0.00           C  
HETATM   18  C   UNL     1       8.734   8.965  11.427  1.00  0.00           C  
HETATM   19  C   UNL     1       7.533   9.329  12.070  1.00  0.00           C  
HETATM   20  C   UNL     1       7.425   9.222  13.459  1.00  0.00           C  
HETATM   21  C   UNL     1       6.211   9.571  14.100  1.00  0.00           C  
HETATM   22  N   UNL     1       5.146   9.971  13.401  1.00  0.00           N  
HETATM   23  C   UNL     1       5.221  10.068  12.069  1.00  0.00           C  
HETATM   24  C   UNL     1       6.398   9.744  11.392  1.00  0.00           C  
HETATM   25  C   UNL     1       8.658   7.872  10.633  1.00  0.00           C  
HETATM   26  N   UNL     1       9.661   7.290   9.952  1.00  0.00           N  
HETATM   27  C   UNL     1       7.568   7.147  10.352  1.00  0.00           C  
HETATM   28  C   UNL     1       7.876   6.161   9.519  1.00  0.00           C  
HETATM   29  C   UNL     1       9.183   6.235   9.242  1.00  0.00           C  
HETATM   30  C   UNL     1       9.929   5.398   8.465  1.00  0.00           C  
HETATM   31  C   UNL     1       9.232   4.449   7.635  1.00  0.00           C  
HETATM   32  C   UNL     1       9.500   3.090   7.598  1.00  0.00           C  
HETATM   33  C   UNL     1       8.827   2.240   6.727  1.00  0.00           C  
HETATM   34  N   UNL     1       7.868   2.728   5.897  1.00  0.00           N  
HETATM   35  C   UNL     1       7.587   4.024   5.903  1.00  0.00           C  
HETATM   36  C   UNL     1       8.270   4.894   6.751  1.00  0.00           C  
HETATM   37  C   UNL     1      11.267   5.492   8.265  1.00  0.00           C  
HETATM   38  N   UNL     1      12.113   6.389   8.803  1.00  0.00           N  
HETATM   39  C   UNL     1      12.013   4.706   7.509  1.00  0.00           C  
HETATM   40  C   UNL     1      13.258   5.105   7.532  1.00  0.00           C  
HETATM   41  C   UNL     1      13.368   6.164   8.312  1.00  0.00           C  
HETATM   42  C   UNL     1      14.517   6.873   8.578  1.00  0.00           C  
HETATM   43  C   UNL     1      15.731   6.500   7.938  1.00  0.00           C  
HETATM   44  C   UNL     1      15.839   6.496   6.553  1.00  0.00           C  
HETATM   45  C   UNL     1      17.021   6.156   5.888  1.00  0.00           C  
HETATM   46  N   UNL     1      18.108   5.826   6.577  1.00  0.00           N  
HETATM   47  C   UNL     1      18.040   5.824   7.937  1.00  0.00           C  
HETATM   48  C   UNL     1      16.866   6.167   8.633  1.00  0.00           C  
HETATM   49 FE   UNL     1      11.624   7.837  10.028  1.00  0.00          Fe  
HETATM   50  H   UNL     1      13.020  13.124  11.062  1.00  0.00           H  
HETATM   51  H   UNL     1      14.280  14.906  12.181  1.00  0.00           H  
HETATM   52  H   UNL     1      16.545  12.134  14.313  1.00  0.00           H  
HETATM   53  H   UNL     1      15.207  10.309  13.353  1.00  0.00           H  
HETATM   54  H   UNL     1      15.915  10.604  10.662  1.00  0.00           H  
HETATM   55  H   UNL     1      16.623   8.647   9.151  1.00  0.00           H  
HETATM   56  H   UNL     1      11.576  12.045  13.065  1.00  0.00           H  
HETATM   57  H   UNL     1       9.136  11.292  12.988  1.00  0.00           H  
HETATM   58  H   UNL     1       8.265   8.874  14.042  1.00  0.00           H  
HETATM   59  H   UNL     1       6.145   9.512  15.176  1.00  0.00           H  
HETATM   60  H   UNL     1       4.359  10.401  11.510  1.00  0.00           H  
HETATM   61  H   UNL     1       6.425   9.819  10.315  1.00  0.00           H  
HETATM   62  H   UNL     1       6.581   7.337  10.746  1.00  0.00           H  
HETATM   63  H   UNL     1       7.189   5.424   9.131  1.00  0.00           H  
HETATM   64  H   UNL     1      10.249   2.682   8.261  1.00  0.00           H  
HETATM   65  H   UNL     1       9.068   1.187   6.710  1.00  0.00           H  
HETATM   66  H   UNL     1       6.822   4.409   5.245  1.00  0.00           H  
HETATM   67  H   UNL     1       8.039   5.949   6.715  1.00  0.00           H  
HETATM   68  H   UNL     1      11.647   3.856   6.952  1.00  0.00           H  
HETATM   69  H   UNL     1      14.071   4.640   6.995  1.00  0.00           H  
HETATM   70  H   UNL     1      14.974   6.767   5.966  1.00  0.00           H  
HETATM   71  H   UNL     1      17.051   6.162   4.808  1.00  0.00           H  
HETATM   72  H   UNL     1      18.919   5.549   8.502  1.00  0.00           H  
HETATM   73  H   UNL     1      16.859   6.168   9.713  1.00  0.00           H  
CONECT    1    6    6    2   50                                       
CONECT    2    1    3    3   51                                       
CONECT    3    2    2    4                                            
CONECT    4    5    5    3   52                                       
CONECT    5    6    4    4   53                                       
CONECT    6    7    1    1    5                                       
CONECT    7    8    8   13    6                                       
CONECT    8   12    9    7    7                                       
CONECT    9   10   10    8   54                                       
CONECT   10   11    9    9   55                                       
CONECT   11   42   42   10   12                                       
CONECT   12   11   49    8                                            
CONECT   13   14   14    7   15                                       
CONECT   14   49   17   13   13                                       
CONECT   15   13   16   16   56                                       
CONECT   16   17   15   15   57                                       
CONECT   17   14   18   18   16                                       
CONECT   18   25   17   17   19                                       
CONECT   19   24   18   20   20                                       
CONECT   20   19   19   21   58                                       
CONECT   21   22   22   20   59                                       
CONECT   22   23   21   21                                            
CONECT   23   24   24   22   60                                       
CONECT   24   23   23   19   61                                       
CONECT   25   26   27   27   18                                       
CONECT   26   29   49   25                                            
CONECT   27   28   25   25   62                                       
CONECT   28   29   29   27   63                                       
CONECT   29   30   28   28   26                                       
CONECT   30   31   37   37   29                                       
CONECT   31   36   36   32   30                                       
CONECT   32   33   33   31   64                                       
CONECT   33   34   32   32   65                                       
CONECT   34   35   35   33                                            
CONECT   35   34   34   36   66                                       
CONECT   36   35   31   31   67                                       
CONECT   37   39   30   30   38                                       
CONECT   38   37   41   41   49                                       
CONECT   39   40   40   37   68                                       
CONECT   40   39   39   41   69                                       
CONECT   41   40   42   38   38                                       
CONECT   42   43   41   11   11                                       
CONECT   43   44   42   48   48                                       
CONECT   44   45   45   43   70                                       
CONECT   45   44   44   46   71                                       
CONECT   46   45   47   47                                            
CONECT   47   46   46   48   72                                       
CONECT   48   47   43   43   73                                       
CONECT   49   38   26   12   14                                       
CONECT   50    1                                                      
CONECT   51    2                                                      
CONECT   52    4                                                      
CONECT   53    5                                                      
CONECT   54    9                                                      
CONECT   55   10                                                      
CONECT   56   15                                                      
CONECT   57   16                                                      
CONECT   58   20                                                      
CONECT   59   21                                                      
CONECT   60   23                                                      
CONECT   61   24                                                      
CONECT   62   27                                                      
CONECT   63   28                                                      
CONECT   64   32                                                      
CONECT   65   33                                                      
CONECT   66   35                                                      
CONECT   67   36                                                      
CONECT   68   39                                                      
CONECT   69   40                                                      
CONECT   70   44                                                      
CONECT   71   45                                                      
CONECT   72   47                                                      
CONECT   73   48                                                      
MASTER        0    0    0    0    0    0    0    0   73    0   73    0
END
