COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      21.937  18.134  14.756  1.00  0.00           O  
HETATM    2  O   UNL     1      25.682  18.551  17.854  1.00  0.00           O  
HETATM    3  O   UNL     1      23.684  18.966  19.830  1.00  0.00           O  
HETATM    4  O   UNL     1      22.017  18.638  22.073  1.00  0.00           O  
HETATM    5  O   UNL     1      21.057  21.202  21.245  1.00  0.00           O  
HETATM    6  O   UNL     1      18.449  21.911  22.027  1.00  0.00           O  
HETATM    7  O   UNL     1      18.587  23.601  19.812  1.00  0.00           O  
HETATM    8  O   UNL     1      17.972  25.476  17.830  1.00  0.00           O  
HETATM    9  O   UNL     1      20.611  24.952  16.960  1.00  0.00           O  
HETATM   10  O   UNL     1      21.197  25.443  14.226  1.00  0.00           O  
HETATM   11  O   UNL     1      23.058  23.412  14.597  1.00  0.00           O  
HETATM   12  O   UNL     1      20.166  20.212  15.033  1.00  0.00           O  
HETATM   13  O   UNL     1      20.479  18.469  17.079  1.00  0.00           O  
HETATM   14  O   UNL     1      25.201  21.675  14.204  1.00  0.00           O  
HETATM   15  O   UNL     1      22.837  21.238  19.004  1.00  0.00           O  
HETATM   16  O   UNL     1      20.907  22.917  18.960  1.00  0.00           O  
HETATM   17  O   UNL     1      22.532  22.867  17.045  1.00  0.00           O  
HETATM   18  O   UNL     1      25.594  20.805  19.398  1.00  0.00           O  
HETATM   19  O   UNL     1      23.635  20.846  21.661  1.00  0.00           O  
HETATM   20  O   UNL     1      20.494  23.739  21.685  1.00  0.00           O  
HETATM   21  O   UNL     1      20.259  25.691  19.443  1.00  0.00           O  
HETATM   22  O   UNL     1      23.027  25.605  16.212  1.00  0.00           O  
HETATM   23  O   UNL     1      25.167  23.585  16.181  1.00  0.00           O  
HETATM   24  O   UNL     1      18.423  20.238  17.002  1.00  0.00           O  
HETATM   25  O   UNL     1      18.400  18.274  18.909  1.00  0.00           O  
HETATM   26  O   UNL     1      26.580  23.019  18.301  1.00  0.00           O  
HETATM   27  O   UNL     1      28.191  21.299  19.857  1.00  0.00           O  
HETATM   28  O   UNL     1      26.215  21.721  21.796  1.00  0.00           O  
HETATM   29  O   UNL     1      24.664  21.465  24.105  1.00  0.00           O  
HETATM   30  O   UNL     1      22.866  23.157  22.745  1.00  0.00           O  
HETATM   31  O   UNL     1      21.008  24.746  24.172  1.00  0.00           O  
HETATM   32  O   UNL     1      21.144  26.365  21.926  1.00  0.00           O  
HETATM   33  O   UNL     1      20.570  28.335  20.043  1.00  0.00           O  
HETATM   34  O   UNL     1      22.406  26.926  18.442  1.00  0.00           O  
HETATM   35  O   UNL     1      23.784  28.254  16.365  1.00  0.00           O  
HETATM   36  O   UNL     1      18.781  22.978  17.154  1.00  0.00           O  
HETATM   37  O   UNL     1      23.078  19.106  17.161  1.00  0.00           O  
HETATM   38  O   UNL     1      25.614  26.197  16.662  1.00  0.00           O  
HETATM   39  O   UNL     1      27.781  24.457  16.279  1.00  0.00           O  
HETATM   40  O   UNL     1      24.635  23.233  20.449  1.00  0.00           O  
HETATM   41  O   UNL     1      22.775  24.967  20.495  1.00  0.00           O  
HETATM   42  O   UNL     1      24.423  24.886  18.568  1.00  0.00           O  
HETATM   43  O   UNL     1      25.164  25.658  20.813  1.00  0.00           O  
HETATM   44  O   UNL     1      27.381  23.833  20.629  1.00  0.00           O  
HETATM   45  O   UNL     1      25.312  23.913  23.069  1.00  0.00           O  
HETATM   46  O   UNL     1      23.432  25.635  23.162  1.00  0.00           O  
HETATM   47  O   UNL     1      23.179  27.697  20.798  1.00  0.00           O  
HETATM   48  O   UNL     1      20.414  22.990  15.179  1.00  0.00           O  
HETATM   49  O   UNL     1      20.960  19.138  19.610  1.00  0.00           O  
HETATM   50  O   UNL     1      24.870  27.650  18.801  1.00  0.00           O  
HETATM   51  O   UNL     1      27.193  25.528  18.737  1.00  0.00           O  
HETATM   52  O   UNL     1      29.242  25.985  20.593  1.00  0.00           O  
HETATM   53  O   UNL     1      27.133  25.770  22.490  1.00  0.00           O  
HETATM   54  O   UNL     1      25.712  26.049  24.845  1.00  0.00           O  
HETATM   55  O   UNL     1      25.203  27.577  22.566  1.00  0.00           O  
HETATM   56  O   UNL     1      25.170  29.702  20.699  1.00  0.00           O  
HETATM   57  O   UNL     1      26.931  27.519  20.533  1.00  0.00           O  
HETATM   58  O   UNL     1      19.067  20.944  19.540  1.00  0.00           O  
HETATM   59  O   UNL     1      22.829  20.768  15.245  1.00  0.00           O  
HETATM   60  O   UNL     1      20.944  20.926  17.402  1.00  0.00           O  
HETATM   61  O   UNL     1      24.814  21.066  16.905  1.00  0.00           O  
HETATM   62  P   UNL     1      21.817  22.002  18.106  1.00  0.00           P  
HETATM   63  P   UNL     1      24.217  24.647  20.060  1.00  0.00           P  
HETATM   64  W   UNL     1      21.590  19.439  15.812  1.00  0.00           W  
HETATM   65  W   UNL     1      24.507  22.212  22.554  1.00  0.00           W  
HETATM   66  W   UNL     1      21.816  24.746  22.658  1.00  0.00           W  
HETATM   67  W   UNL     1      21.482  26.870  20.082  1.00  0.00           W  
HETATM   68  W   UNL     1      23.895  26.769  17.272  1.00  0.00           W  
HETATM   69  W   UNL     1      26.389  24.557  17.291  1.00  0.00           W  
HETATM   70  W   UNL     1      27.547  25.708  20.608  1.00  0.00           W  
HETATM   71  W   UNL     1      25.339  25.787  23.195  1.00  0.00           W  
HETATM   72  W   UNL     1      25.020  27.982  20.640  1.00  0.00           W  
HETATM   73  W   UNL     1      19.424  19.518  18.310  1.00  0.00           W  
HETATM   74  W   UNL     1      24.467  19.706  18.224  1.00  0.00           W  
HETATM   75  W   UNL     1      22.247  19.765  20.784  1.00  0.00           W  
HETATM   76  W   UNL     1      19.572  22.325  20.788  1.00  0.00           W  
HETATM   77  W   UNL     1      19.259  24.378  18.155  1.00  0.00           W  
HETATM   78  W   UNL     1      21.571  24.305  15.463  1.00  0.00           W  
HETATM   79  W   UNL     1      24.155  22.135  15.492  1.00  0.00           W  
HETATM   80  W   UNL     1      26.689  22.112  19.995  1.00  0.00           W  
HETATM   81 ZR   UNL     1      18.596  21.720  15.383  1.00  0.00          Zr  
HETATM   82  H   UNL     1       0.000   0.000   0.000  1.00  0.00           H  
HETATM   83  H   UNL     1       0.000   0.000   0.000  1.00  0.00           H  
CONECT    1   64   64                                                 
CONECT    2   74   74                                                 
CONECT    3   74   75                                                 
CONECT    4   75   75                                                 
CONECT    5   75   76                                                 
CONECT    6   76   76                                                 
CONECT    7   76   77                                                 
CONECT    8   77   77                                                 
CONECT    9   77   78                                                 
CONECT   10   78   78                                                 
CONECT   11   78   79                                                 
CONECT   12   64   81                                                 
CONECT   13   64   73                                                 
CONECT   14   79   79                                                 
CONECT   15   62   74   75                                            
CONECT   16   62   76   77                                            
CONECT   17   62   78   79                                            
CONECT   18   74   80                                                 
CONECT   19   65   75                                                 
CONECT   20   66   76                                                 
CONECT   21   67   77                                                 
CONECT   22   68   78                                                 
CONECT   23   69   79                                                 
CONECT   24   73   81                                                 
CONECT   25   73                                                      
CONECT   26   69   80                                                 
CONECT   27   80   80                                                 
CONECT   28   65   80                                                 
CONECT   29   65   65                                                 
CONECT   30   65   66                                                 
CONECT   31   66   66                                                 
CONECT   32   66   67                                                 
CONECT   33   67   67                                                 
CONECT   34   67   68                                                 
CONECT   35   68   68                                                 
CONECT   36   77   81                                                 
CONECT   37   64   74                                                 
CONECT   38   68   69                                                 
CONECT   39   69   69                                                 
CONECT   40   63   65   80                                            
CONECT   41   63   66   67                                            
CONECT   42   63   68   69                                            
CONECT   43   63   70   71   72                                       
CONECT   44   70   80                                                 
CONECT   45   65   71                                                 
CONECT   46   66   71                                                 
CONECT   47   67   72                                                 
CONECT   48   78   81                                                 
CONECT   49   73   75                                                 
CONECT   50   68   72                                                 
CONECT   51   69   70                                                 
CONECT   52   70   70                                                 
CONECT   53   70   71                                                 
CONECT   54   71   71                                                 
CONECT   55   71   72                                                 
CONECT   56   72   72                                                 
CONECT   57   70   72                                                 
CONECT   58   73   76                                                 
CONECT   59   64   79                                                 
CONECT   60   62   64   73                                            
CONECT   61   74   79                                                 
CONECT   62   15   16   17   60                                       
CONECT   62   82                                                      
CONECT   63   40   41   42   43                                       
CONECT   63   83                                                      
CONECT   64    1    1   12   13                                       
CONECT   64   37   59   60                                            
CONECT   65   19   28   29   29                                       
CONECT   65   30   40   45                                            
CONECT   66   20   30   31   31                                       
CONECT   66   32   41   46                                            
CONECT   67   21   32   33   33                                       
CONECT   67   34   41   47                                            
CONECT   68   22   34   35   35                                       
CONECT   68   38   42   50                                            
CONECT   69   23   26   38   39                                       
CONECT   69   39   42   51                                            
CONECT   70   43   44   51   52                                       
CONECT   70   52   53   57                                            
CONECT   71   43   45   46   53                                       
CONECT   71   54   54   55                                            
CONECT   72   43   47   50   55                                       
CONECT   72   56   56   57                                            
CONECT   73   13   24   25   49                                       
CONECT   73   58   60                                                 
CONECT   74    2    2    3   15                                       
CONECT   74   18   37   61                                            
CONECT   75    3    4    4    5                                       
CONECT   75   15   19   49                                            
CONECT   76    5    6    6    7                                       
CONECT   76   16   20   58                                            
CONECT   77    7    8    8    9                                       
CONECT   77   16   21   36                                            
CONECT   78    9   10   10   11                                       
CONECT   78   17   22   48                                            
CONECT   79   11   14   14   17                                       
CONECT   79   23   59   61                                            
CONECT   80   18   26   27   27                                       
CONECT   80   28   40   44                                            
CONECT   81   12   24   36   48                                       
CONECT   82   62                                                      
CONECT   83   63                                                      
MASTER        0    0    0    0    0    0    0    0   83    0   83    0
END
