COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1 FE   UNL     1     -29.665  24.895  -7.195  1.00  0.00          Fe  
HETATM    2  O   UNL     1     -30.030  24.978  -5.265  1.00  0.00           O  
HETATM    3  O   UNL     1     -27.878  24.440  -6.541  1.00  0.00           O  
HETATM    4  O   UNL     1     -29.875  23.023  -7.750  1.00  0.00           O  
HETATM    5  O   UNL     1     -31.613  24.878  -7.272  1.00  0.00           O  
HETATM    6  O   UNL     1     -30.279  26.734  -6.972  1.00  0.00           O  
HETATM    7  O   UNL     1     -29.286  25.522  -9.053  1.00  0.00           O  
HETATM    8  N   UNL     1     -28.894  24.682  -4.580  1.00  0.00           N  
HETATM    9  C   UNL     1     -27.796  24.402  -5.286  1.00  0.00           C  
HETATM   10  C   UNL     1     -26.423  24.029  -4.608  1.00  0.00           C  
HETATM   11  C   UNL     1     -26.377  22.559  -4.059  1.00  0.00           C  
HETATM   12  C   UNL     1     -26.391  21.456  -5.160  1.00  0.00           C  
HETATM   13  O   UNL     1     -25.483  21.441  -6.051  1.00  0.00           O  
HETATM   14  N   UNL     1     -27.390  20.496  -5.138  1.00  0.00           N  
HETATM   15  C   UNL     1     -27.293  19.560  -6.142  1.00  0.00           C  
HETATM   16  C   UNL     1     -28.155  19.988  -7.367  1.00  0.00           C  
HETATM   17  C   UNL     1     -30.426  20.443  -8.362  1.00  0.00           C  
HETATM   18  C   UNL     1     -29.676  20.000  -7.080  1.00  0.00           C  
HETATM   19  C   UNL     1     -31.583  21.425  -8.049  1.00  0.00           C  
HETATM   20  N   UNL     1     -31.171  22.705  -7.746  1.00  0.00           N  
HETATM   21  C   UNL     1     -32.046  23.693  -7.497  1.00  0.00           C  
HETATM   22  C   UNL     1     -33.590  23.328  -7.560  1.00  0.00           C  
HETATM   23  C   UNL     1     -34.591  24.526  -7.296  1.00  0.00           C  
HETATM   24  C   UNL     1     -34.248  25.424  -6.069  1.00  0.00           C  
HETATM   25  O   UNL     1     -33.954  24.902  -4.977  1.00  0.00           O  
HETATM   26  N   UNL     1     -34.279  26.789  -6.224  1.00  0.00           N  
HETATM   27  C   UNL     1     -33.958  27.533  -5.114  1.00  0.00           C  
HETATM   28  C   UNL     1     -33.351  28.904  -5.572  1.00  0.00           C  
HETATM   29  C   UNL     1     -32.551  28.669  -6.877  1.00  0.00           C  
HETATM   30  C   UNL     1     -31.115  29.231  -6.865  1.00  0.00           C  
HETATM   31  C   UNL     1     -30.420  28.801  -8.200  1.00  0.00           C  
HETATM   32  N   UNL     1     -30.074  27.446  -8.134  1.00  0.00           N  
HETATM   33  C   UNL     1     -29.558  26.770  -9.185  1.00  0.00           C  
HETATM   34  C   UNL     1     -29.325  27.522 -10.531  1.00  0.00           C  
HETATM   35  C   UNL     1     -28.906  24.681  -3.217  1.00  0.00           C  
HETATM   36  C   UNL     1       0.000   0.000   0.000  1.00  0.00           C  
HETATM   37  C   UNL     1       0.000   0.000   0.000  1.00  0.00           C  
HETATM   38  C   UNL     1       0.000   0.000   0.000  1.00  0.00           C  
HETATM   39  C   UNL     1       0.000   0.000   0.000  1.00  0.00           C  
HETATM   40  C   UNL     1       0.000   0.000   0.000  1.00  0.00           C  
HETATM   41  N   UNL     1       0.000   0.000   0.000  1.00  0.00           N  
HETATM   42  O   UNL     1       0.000   0.000   0.000  1.00  0.00           O  
HETATM   43  S   UNL     1       0.000   0.000   0.000  1.00  0.00           S  
HETATM   44  O   UNL     1       0.000   0.000   0.000  1.00  0.00           O  
HETATM   45  O   UNL     1       0.000   0.000   0.000  1.00  0.00           O  
HETATM   46  C   UNL     1       0.000   0.000   0.000  1.00  0.00           C  
HETATM   47  H   UNL     1     -25.623  24.148  -5.353  1.00  0.00           H  
HETATM   48  H   UNL     1     -26.249  24.720  -3.770  1.00  0.00           H  
HETATM   49  H   UNL     1     -25.457  22.442  -3.467  1.00  0.00           H  
HETATM   50  H   UNL     1     -27.252  22.407  -3.410  1.00  0.00           H  
HETATM   51  H   UNL     1     -28.118  20.484  -4.452  1.00  0.00           H  
HETATM   52  H   UNL     1     -26.242  19.469  -6.452  1.00  0.00           H  
HETATM   53  H   UNL     1     -27.651  18.589  -5.768  1.00  0.00           H  
HETATM   54  H   UNL     1     -27.850  21.001  -7.670  1.00  0.00           H  
HETATM   55  H   UNL     1     -27.962  19.285  -8.191  1.00  0.00           H  
HETATM   56  H   UNL     1     -29.713  20.938  -9.037  1.00  0.00           H  
HETATM   57  H   UNL     1     -30.841  19.552  -8.856  1.00  0.00           H  
HETATM   58  H   UNL     1     -30.005  18.991  -6.790  1.00  0.00           H  
HETATM   59  H   UNL     1     -29.892  20.705  -6.264  1.00  0.00           H  
HETATM   60  H   UNL     1     -32.242  21.474  -8.929  1.00  0.00           H  
HETATM   61  H   UNL     1     -32.147  21.032  -7.190  1.00  0.00           H  
HETATM   62  H   UNL     1     -33.801  22.926  -8.562  1.00  0.00           H  
HETATM   63  H   UNL     1     -33.785  22.552  -6.805  1.00  0.00           H  
HETATM   64  H   UNL     1     -34.601  25.164  -8.192  1.00  0.00           H  
HETATM   65  H   UNL     1     -35.594  24.102  -7.137  1.00  0.00           H  
HETATM   66  H   UNL     1     -34.521  27.217  -7.095  1.00  0.00           H  
HETATM   67  H   UNL     1     -34.864  27.713  -4.517  1.00  0.00           H  
HETATM   68  H   UNL     1     -33.220  26.988  -4.506  1.00  0.00           H  
HETATM   69  H   UNL     1     -34.160  29.626  -5.756  1.00  0.00           H  
HETATM   70  H   UNL     1     -32.682  29.294  -4.791  1.00  0.00           H  
HETATM   71  H   UNL     1     -32.493  27.585  -7.052  1.00  0.00           H  
HETATM   72  H   UNL     1     -33.098  29.145  -7.704  1.00  0.00           H  
HETATM   73  H   UNL     1     -31.144  30.328  -6.795  1.00  0.00           H  
HETATM   74  H   UNL     1     -30.561  28.823  -6.007  1.00  0.00           H  
HETATM   75  H   UNL     1     -31.111  28.962  -9.041  1.00  0.00           H  
HETATM   76  H   UNL     1     -29.512  29.404  -8.351  1.00  0.00           H  
HETATM   77  H   UNL     1     -29.981  27.307 -11.387  1.00  0.00           H  
HETATM   78  H   UNL     1     -29.086  28.596 -10.513  1.00  0.00           H  
HETATM   79  H   UNL     1     -28.682  25.667  -2.783  1.00  0.00           H  
HETATM   80  H   UNL     1     -29.847  24.300  -2.794  1.00  0.00           H  
HETATM   81  H   UNL     1       0.000   0.000   0.000  1.00  0.00           H  
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  
HETATM   84  H   UNL     1       0.000   0.000   0.000  1.00  0.00           H  
HETATM   85  H   UNL     1       0.000   0.000   0.000  1.00  0.00           H  
HETATM   86  H   UNL     1       0.000   0.000   0.000  1.00  0.00           H  
HETATM   87  H   UNL     1       0.000   0.000   0.000  1.00  0.00           H  
HETATM   88  H   UNL     1       0.000   0.000   0.000  1.00  0.00           H  
HETATM   89  H   UNL     1       0.000   0.000   0.000  1.00  0.00           H  
HETATM   90  H   UNL     1       0.000   0.000   0.000  1.00  0.00           H  
HETATM   91  H   UNL     1       0.000   0.000   0.000  1.00  0.00           H  
HETATM   92  H   UNL     1       0.000   0.000   0.000  1.00  0.00           H  
HETATM   93  H   UNL     1       0.000   0.000   0.000  1.00  0.00           H  
HETATM   94  H   UNL     1       0.000   0.000   0.000  1.00  0.00           H  
HETATM   95  H   UNL     1       0.000   0.000   0.000  1.00  0.00           H  
CONECT    1    2    3    4    5                                       
CONECT    1    6    7                                                 
CONECT    2    1    8                                                 
CONECT    3    1    9    9                                            
CONECT    4    1   20                                                 
CONECT    5    1   21   21                                            
CONECT    6    1   32                                                 
CONECT    7    1   33   33                                            
CONECT    8    2    9   35                                            
CONECT    9    3    3    8   10                                       
CONECT   10    9   11   47   48                                       
CONECT   11   10   12   49   50                                       
CONECT   12   11   13   13   14                                       
CONECT   13   12   12                                                 
CONECT   14   12   15   51                                            
CONECT   15   14   16   52   53                                       
CONECT   16   15   18   54   55                                       
CONECT   17   18   19   56   57                                       
CONECT   18   16   17   58   59                                       
CONECT   19   17   20   60   61                                       
CONECT   20    4   19   21                                            
CONECT   21    5    5   20   22                                       
CONECT   22   21   23   62   63                                       
CONECT   23   22   24   64   65                                       
CONECT   24   23   25   25   26                                       
CONECT   25   24   24                                                 
CONECT   26   24   27   66                                            
CONECT   27   26   28   67   68                                       
CONECT   28   27   29   69   70                                       
CONECT   29   28   30   71   72                                       
CONECT   30   29   31   73   74                                       
CONECT   31   30   32   75   76                                       
CONECT   32    6   31   33                                            
CONECT   33    7    7   32   34                                       
CONECT   34   33   36   77   78                                       
CONECT   35    8   37   79   80                                       
CONECT   36   34   81   82   83                                       
CONECT   37   35   38   84   85                                       
CONECT   38   37   39   86   87                                       
CONECT   39   38   40   88   89                                       
CONECT   40   39   41   90   91                                       
CONECT   41   40   42   92                                            
CONECT   42   41   43                                                 
CONECT   43   42   44   44   45                                       
CONECT   43   45   46                                                 
CONECT   44   43   43                                                 
CONECT   45   43   43                                                 
CONECT   46   43   93   94   95                                       
CONECT   47   10                                                      
CONECT   48   10                                                      
CONECT   49   11                                                      
CONECT   50   11                                                      
CONECT   51   14                                                      
CONECT   52   15                                                      
CONECT   53   15                                                      
CONECT   54   16                                                      
CONECT   55   16                                                      
CONECT   56   17                                                      
CONECT   57   17                                                      
CONECT   58   18                                                      
CONECT   59   18                                                      
CONECT   60   19                                                      
CONECT   61   19                                                      
CONECT   62   22                                                      
CONECT   63   22                                                      
CONECT   64   23                                                      
CONECT   65   23                                                      
CONECT   66   26                                                      
CONECT   67   27                                                      
CONECT   68   27                                                      
CONECT   69   28                                                      
CONECT   70   28                                                      
CONECT   71   29                                                      
CONECT   72   29                                                      
CONECT   73   30                                                      
CONECT   74   30                                                      
CONECT   75   31                                                      
CONECT   76   31                                                      
CONECT   77   34                                                      
CONECT   78   34                                                      
CONECT   79   35                                                      
CONECT   80   35                                                      
CONECT   81   36                                                      
CONECT   82   36                                                      
CONECT   83   36                                                      
CONECT   84   37                                                      
CONECT   85   37                                                      
CONECT   86   38                                                      
CONECT   87   38                                                      
CONECT   88   39                                                      
CONECT   89   39                                                      
CONECT   90   40                                                      
CONECT   91   40                                                      
CONECT   92   41                                                      
CONECT   93   46                                                      
CONECT   94   46                                                      
CONECT   95   46                                                      
MASTER        0    0    0    0    0    0    0    0   95    0   95    0
END
