COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1     -20.505  19.313 124.978  1.00  0.00           C  
HETATM    2  C   UNL     1     -19.428  19.440 124.090  1.00  0.00           C  
HETATM    3  C   UNL     1     -19.449  20.099 122.854  1.00  0.00           C  
HETATM    4  C   UNL     1     -18.165  19.945 122.304  1.00  0.00           C  
HETATM    5  C   UNL     1     -17.446  19.219 123.225  1.00  0.00           C  
HETATM    6  C   UNL     1     -20.643  20.833 122.251  1.00  0.00           C  
HETATM    7  C   UNL     1     -17.558  20.451 121.001  1.00  0.00           C  
HETATM    8  C   UNL     1     -17.462  22.002 121.024  1.00  0.00           C  
HETATM    9  C   UNL     1     -16.180  22.601 121.606  1.00  0.00           C  
HETATM   10  C   UNL     1     -16.145  18.823 123.024  1.00  0.00           C  
HETATM   11  C   UNL     1     -15.462  17.801 123.699  1.00  0.00           C  
HETATM   12  C   UNL     1     -14.276  17.176 123.266  1.00  0.00           C  
HETATM   13  C   UNL     1     -13.927  16.245 124.252  1.00  0.00           C  
HETATM   14  C   UNL     1     -14.899  16.392 125.248  1.00  0.00           C  
HETATM   15  C   UNL     1     -13.567  17.463 121.954  1.00  0.00           C  
HETATM   16  C   UNL     1     -12.728  15.322 124.299  1.00  0.00           C  
HETATM   17  C   UNL     1     -11.589  16.099 124.935  1.00  0.00           C  
HETATM   18  C   UNL     1     -10.231  15.453 125.157  1.00  0.00           C  
HETATM   19  C   UNL     1     -14.902  15.691 126.452  1.00  0.00           C  
HETATM   20  C   UNL     1     -15.855  15.844 127.483  1.00  0.00           C  
HETATM   21  C   UNL     1     -15.807  15.139 128.698  1.00  0.00           C  
HETATM   22  C   UNL     1     -16.949  15.560 129.408  1.00  0.00           C  
HETATM   23  C   UNL     1     -17.611  16.479 128.582  1.00  0.00           C  
HETATM   24  C   UNL     1     -17.493  15.186 130.801  1.00  0.00           C  
HETATM   25  C   UNL     1     -14.680  14.161 129.096  1.00  0.00           C  
HETATM   26  C   UNL     1     -15.110  13.031 130.038  1.00  0.00           C  
HETATM   27  C   UNL     1     -15.923  11.975 129.314  1.00  0.00           C  
HETATM   28  C   UNL     1     -18.824  17.081 128.925  1.00  0.00           C  
HETATM   29  C   UNL     1     -19.696  17.701 128.014  1.00  0.00           C  
HETATM   30  C   UNL     1     -21.054  17.981 128.274  1.00  0.00           C  
HETATM   31  C   UNL     1     -21.537  18.631 127.103  1.00  0.00           C  
HETATM   32  C   UNL     1     -20.446  18.701 126.228  1.00  0.00           C  
HETATM   33  C   UNL     1     -21.822  17.644 129.555  1.00  0.00           C  
HETATM   34  C   UNL     1     -22.942  19.175 126.831  1.00  0.00           C  
HETATM   35  C   UNL     1     -24.076  18.579 126.416  1.00  0.00           C  
HETATM   36  N   UNL     1     -18.188  18.891 124.333  1.00  0.00           N  
HETATM   37  N   UNL     1     -15.853  17.328 124.922  1.00  0.00           N  
HETATM   38  N   UNL     1     -16.959  16.667 127.386  1.00  0.00           N  
HETATM   39  N   UNL     1     -19.307  18.128 126.762  1.00  0.00           N  
HETATM   40  O   UNL     1     -15.397  21.747 122.063  1.00  0.00           O  
HETATM   41  O   UNL     1     -15.955  23.845 121.593  1.00  0.00           O  
HETATM   42  O   UNL     1     -10.081  14.251 125.550  1.00  0.00           O  
HETATM   43  O   UNL     1      -9.326  16.258 124.885  1.00  0.00           O  
HETATM   44  O   UNL     1     -17.079  12.309 128.976  1.00  0.00           O  
HETATM   45  O   UNL     1     -15.354  10.889 129.098  1.00  0.00           O  
HETATM   46 FE   UNL     1     -17.499  17.919 125.919  1.00  0.00          Fe  
HETATM   47  H   UNL     1     -21.456  19.722 124.669  1.00  0.00           H  
HETATM   48  H   UNL     1     -21.500  20.766 122.938  1.00  0.00           H  
HETATM   49  H   UNL     1     -20.382  21.890 122.092  1.00  0.00           H  
HETATM   50  H   UNL     1     -20.908  20.372 121.288  1.00  0.00           H  
HETATM   51  H   UNL     1     -18.192  20.138 120.158  1.00  0.00           H  
HETATM   52  H   UNL     1     -16.551  20.026 120.879  1.00  0.00           H  
HETATM   53  H   UNL     1     -17.556  22.357 119.987  1.00  0.00           H  
HETATM   54  H   UNL     1     -18.307  22.380 121.619  1.00  0.00           H  
HETATM   55  H   UNL     1     -15.590  19.355 122.266  1.00  0.00           H  
HETATM   56  H   UNL     1     -12.669  16.833 121.876  1.00  0.00           H  
HETATM   57  H   UNL     1     -14.244  17.242 121.116  1.00  0.00           H  
HETATM   58  H   UNL     1     -13.275  18.523 121.919  1.00  0.00           H  
HETATM   59  H   UNL     1     -12.961  14.432 124.902  1.00  0.00           H  
HETATM   60  H   UNL     1     -12.451  15.012 123.281  1.00  0.00           H  
HETATM   61  H   UNL     1     -11.417  16.979 124.298  1.00  0.00           H  
HETATM   62  H   UNL     1     -11.946  16.425 125.923  1.00  0.00           H  
HETATM   63  H   UNL     1     -14.111  14.972 126.610  1.00  0.00           H  
HETATM   64  H   UNL     1     -18.170  14.324 130.711  1.00  0.00           H  
HETATM   65  H   UNL     1     -16.655  14.927 131.464  1.00  0.00           H  
HETATM   66  H   UNL     1     -18.042  16.041 131.222  1.00  0.00           H  
HETATM   67  H   UNL     1     -14.281  13.707 128.177  1.00  0.00           H  
HETATM   68  H   UNL     1     -13.887  14.738 129.594  1.00  0.00           H  
HETATM   69  H   UNL     1     -14.211  12.560 130.463  1.00  0.00           H  
HETATM   70  H   UNL     1     -15.719  13.456 130.849  1.00  0.00           H  
HETATM   71  H   UNL     1     -19.113  17.069 129.966  1.00  0.00           H  
HETATM   72  H   UNL     1     -21.149  17.140 130.265  1.00  0.00           H  
HETATM   73  H   UNL     1     -22.205  18.571 130.007  1.00  0.00           H  
HETATM   74  H   UNL     1     -22.664  16.979 129.313  1.00  0.00           H  
HETATM   75  H   UNL     1     -23.043  20.236 127.005  1.00  0.00           H  
HETATM   76  H   UNL     1     -24.976  19.162 126.286  1.00  0.00           H  
HETATM   77  H   UNL     1     -24.086  17.518 126.213  1.00  0.00           H  
HETATM   78  H   UNL     1     -14.617  22.177 122.394  1.00  0.00           H  
HETATM   79  H   UNL     1      -9.154  14.050 125.608  1.00  0.00           H  
HETATM   80  H   UNL     1     -15.939  10.314 128.618  1.00  0.00           H  
CONECT    1    2    2   32   47                                       
CONECT    2    3   36    1    1                                       
CONECT    3    6    4    4    2                                       
CONECT    4    7    3    3    5                                       
CONECT    5    4   10   10   36                                       
CONECT    6    3   48   49   50                                       
CONECT    7    8    4   51   52                                       
CONECT    8    7    9   53   54                                       
CONECT    9    8   41   41   40                                       
CONECT   10    5    5   11   55                                       
CONECT   11   10   12   37   37                                       
CONECT   12   15   11   13   13                                       
CONECT   13   12   12   16   14                                       
CONECT   14   13   37   19   19                                       
CONECT   15   12   56   57   58                                       
CONECT   16   13   17   59   60                                       
CONECT   17   16   18   61   62                                       
CONECT   18   43   43   17   42                                       
CONECT   19   14   14   20   63                                       
CONECT   20   19   38   21   21                                       
CONECT   21   20   20   25   22                                       
CONECT   22   23   23   21   24                                       
CONECT   23   38   28   22   22                                       
CONECT   24   22   64   65   66                                       
CONECT   25   21   26   67   68                                       
CONECT   26   25   27   69   70                                       
CONECT   27   44   44   45   26                                       
CONECT   28   29   29   23   71                                       
CONECT   29   39   30   28   28                                       
CONECT   30   31   31   29   33                                       
CONECT   31   32   34   30   30                                       
CONECT   32    1   39   39   31                                       
CONECT   33   30   72   73   74                                       
CONECT   34   35   35   31   75                                       
CONECT   35   34   34   76   77                                       
CONECT   36    5    2   46                                            
CONECT   37   11   11   14   46                                       
CONECT   38   46   20   23                                            
CONECT   39   46   32   32   29                                       
CONECT   40    9   78                                                 
CONECT   41    9    9                                                 
CONECT   42   18   79                                                 
CONECT   43   18   18                                                 
CONECT   44   27   27                                                 
CONECT   45   27   80                                                 
CONECT   46   36   37   39   38                                       
CONECT   47    1                                                      
CONECT   48    6                                                      
CONECT   49    6                                                      
CONECT   50    6                                                      
CONECT   51    7                                                      
CONECT   52    7                                                      
CONECT   53    8                                                      
CONECT   54    8                                                      
CONECT   55   10                                                      
CONECT   56   15                                                      
CONECT   57   15                                                      
CONECT   58   15                                                      
CONECT   59   16                                                      
CONECT   60   16                                                      
CONECT   61   17                                                      
CONECT   62   17                                                      
CONECT   63   19                                                      
CONECT   64   24                                                      
CONECT   65   24                                                      
CONECT   66   24                                                      
CONECT   67   25                                                      
CONECT   68   25                                                      
CONECT   69   26                                                      
CONECT   70   26                                                      
CONECT   71   28                                                      
CONECT   72   33                                                      
CONECT   73   33                                                      
CONECT   74   33                                                      
CONECT   75   34                                                      
CONECT   76   35                                                      
CONECT   77   35                                                      
CONECT   78   40                                                      
CONECT   79   42                                                      
CONECT   80   45                                                      
MASTER        0    0    0    0    0    0    0    0   80    0   80    0
END
