COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1 FE   UNL     1       1.575   0.108  -0.008  1.00  0.00          Fe  
HETATM    2  C   UNL     1      -1.563   0.167  -0.398  1.00  0.00           C  
HETATM    3  C   UNL     1       1.708   2.829  -1.615  1.00  0.00           C  
HETATM    4  C   UNL     1       4.730  -0.120   0.094  1.00  0.00           C  
HETATM    5  C   UNL     1       1.467  -2.733   1.374  1.00  0.00           C  
HETATM    6  N   UNL     1       0.409   1.530  -0.043  1.00  0.00           N1+
HETATM    7  C   UNL     1      -0.927   1.391  -0.056  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.399   2.697   0.200  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.389   3.555  -0.184  1.00  0.00           C  
HETATM   10  C   UNL     1       0.683   2.694  -0.663  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.738   3.077   0.777  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.674   3.007   2.304  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.043   3.272   2.876  1.00  0.00           C  
HETATM   14  O   UNL     1      -4.973   3.494   2.139  1.00  0.00           O  
HETATM   15  O   UNL     1      -4.227   3.261   4.206  1.00  0.00           O  
HETATM   16  C   UNL     1      -0.394   5.061  -0.121  1.00  0.00           C  
HETATM   17  N   UNL     1       2.867   0.738  -1.184  1.00  0.00           N  
HETATM   18  C   UNL     1       2.726   1.915  -1.901  1.00  0.00           C  
HETATM   19  C   UNL     1       3.802   1.860  -2.779  1.00  0.00           C  
HETATM   20  C   UNL     1       4.717   0.905  -2.293  1.00  0.00           C  
HETATM   21  C   UNL     1       4.205   0.425  -1.072  1.00  0.00           C  
HETATM   22  C   UNL     1       3.962   2.680  -4.033  1.00  0.00           C  
HETATM   23  C   UNL     1       5.974   0.487  -2.940  1.00  0.00           C  
HETATM   24  C   UNL     1       6.745  -0.430  -2.365  1.00  0.00           C  
HETATM   25  N   UNL     1       2.673  -0.640   1.266  1.00  0.00           N1+
HETATM   26  C   UNL     1       4.015  -0.523   1.246  1.00  0.00           C  
HETATM   27  C   UNL     1       4.424  -1.015   2.503  1.00  0.00           C  
HETATM   28  C   UNL     1       3.395  -1.845   2.949  1.00  0.00           C  
HETATM   29  C   UNL     1       2.401  -1.808   1.867  1.00  0.00           C  
HETATM   30  C   UNL     1       5.714  -0.708   3.219  1.00  0.00           C  
HETATM   31  C   UNL     1       3.321  -2.590   4.218  1.00  0.00           C  
HETATM   32  C   UNL     1       2.259  -3.341   4.486  1.00  0.00           C  
HETATM   33  N   UNL     1       0.373  -1.287  -0.229  1.00  0.00           N  
HETATM   34  C   UNL     1       0.537  -2.532   0.352  1.00  0.00           C  
HETATM   35  C   UNL     1      -0.428  -3.272  -0.322  1.00  0.00           C  
HETATM   36  C   UNL     1      -1.349  -2.387  -0.863  1.00  0.00           C  
HETATM   37  C   UNL     1      -0.962  -1.098  -0.528  1.00  0.00           C  
HETATM   38  C   UNL     1      -0.466  -4.773  -0.444  1.00  0.00           C  
HETATM   39  C   UNL     1      -2.563  -2.763  -1.674  1.00  0.00           C  
HETATM   40  C   UNL     1      -3.757  -2.967  -0.740  1.00  0.00           C  
HETATM   41  C   UNL     1      -4.971  -3.342  -1.551  1.00  0.00           C  
HETATM   42  O   UNL     1      -6.143  -3.572  -0.939  1.00  0.00           O  
HETATM   43  O   UNL     1      -4.888  -3.437  -2.753  1.00  0.00           O  
HETATM   44  C   UNL     1      -3.017   0.231  -0.644  1.00  0.00           C  
HETATM   45  C   UNL     1      -3.909   0.290   0.430  1.00  0.00           C  
HETATM   46  C   UNL     1      -3.508   0.238  -1.953  1.00  0.00           C  
HETATM   47  C   UNL     1      -5.266   0.349   0.192  1.00  0.00           C  
HETATM   48  C   UNL     1      -4.867   0.297  -2.175  1.00  0.00           C  
HETATM   49  C   UNL     1      -5.745   0.350  -1.106  1.00  0.00           C  
HETATM   50  H   UNL     1       1.709   3.743  -2.191  1.00  0.00           H  
HETATM   51  H   UNL     1       5.801  -0.250   0.123  1.00  0.00           H  
HETATM   52  H   UNL     1       1.468  -3.709   1.836  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.991   4.092   0.470  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.499   2.387   0.412  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.339   2.015   2.608  1.00  0.00           H  
HETATM   56  H   UNL     1      -1.974   3.756   2.673  1.00  0.00           H  
HETATM   57  H   UNL     1      -5.123   3.437   4.526  1.00  0.00           H  
HETATM   58  H   UNL     1      -0.002   5.386   0.842  1.00  0.00           H  
HETATM   59  H   UNL     1       0.230   5.460  -0.921  1.00  0.00           H  
HETATM   60  H   UNL     1      -1.414   5.426  -0.240  1.00  0.00           H  
HETATM   61  H   UNL     1       4.478   3.611  -3.795  1.00  0.00           H  
HETATM   62  H   UNL     1       4.544   2.118  -4.763  1.00  0.00           H  
HETATM   63  H   UNL     1       2.980   2.906  -4.448  1.00  0.00           H  
HETATM   64  H   UNL     1       6.269   0.927  -3.881  1.00  0.00           H  
HETATM   65  H   UNL     1       7.666  -0.736  -2.839  1.00  0.00           H  
HETATM   66  H   UNL     1       6.450  -0.869  -1.423  1.00  0.00           H  
HETATM   67  H   UNL     1       5.578   0.169   3.852  1.00  0.00           H  
HETATM   68  H   UNL     1       6.000  -1.560   3.835  1.00  0.00           H  
HETATM   69  H   UNL     1       6.498  -0.510   2.487  1.00  0.00           H  
HETATM   70  H   UNL     1       4.131  -2.525   4.930  1.00  0.00           H  
HETATM   71  H   UNL     1       2.204  -3.887   5.417  1.00  0.00           H  
HETATM   72  H   UNL     1       1.449  -3.406   3.775  1.00  0.00           H  
HETATM   73  H   UNL     1      -1.034  -5.191   0.387  1.00  0.00           H  
HETATM   74  H   UNL     1      -0.942  -5.049  -1.385  1.00  0.00           H  
HETATM   75  H   UNL     1       0.551  -5.165  -0.422  1.00  0.00           H  
HETATM   76  H   UNL     1      -2.787  -1.965  -2.382  1.00  0.00           H  
HETATM   77  H   UNL     1      -2.365  -3.686  -2.218  1.00  0.00           H  
HETATM   78  H   UNL     1      -3.533  -3.765  -0.032  1.00  0.00           H  
HETATM   79  H   UNL     1      -3.955  -2.043  -0.196  1.00  0.00           H  
HETATM   80  H   UNL     1      -6.893  -3.809  -1.501  1.00  0.00           H  
HETATM   81  H   UNL     1      -3.536   0.289   1.443  1.00  0.00           H  
HETATM   82  H   UNL     1      -2.824   0.197  -2.788  1.00  0.00           H  
HETATM   83  H   UNL     1      -5.957   0.395   1.021  1.00  0.00           H  
HETATM   84  H   UNL     1      -5.248   0.303  -3.186  1.00  0.00           H  
HETATM   85  H   UNL     1      -6.809   0.397  -1.286  1.00  0.00           H  
CONECT    1    6   17   25   33                                       
CONECT    2    7    7   37   44                                       
CONECT    3   10   18   18   50                                       
CONECT    4   21   21   26   51                                       
CONECT    5   29   29   34   52                                       
CONECT    6    1    7   10   10                                       
CONECT    7    2    2    6    8                                       
CONECT    8    7    9    9   11                                       
CONECT    9    8    8   10   16                                       
CONECT   10    3    6    6    9                                       
CONECT   11    8   12   53   54                                       
CONECT   12   11   13   55   56                                       
CONECT   13   12   14   14   15                                       
CONECT   14   13   13                                                 
CONECT   15   13   57                                                 
CONECT   16    9   58   59   60                                       
CONECT   17    1   18   21                                            
CONECT   18    3    3   17   19                                       
CONECT   19   18   20   20   22                                       
CONECT   20   19   19   21   23                                       
CONECT   21    4    4   17   20                                       
CONECT   22   19   61   62   63                                       
CONECT   23   20   24   24   64                                       
CONECT   24   23   23   65   66                                       
CONECT   25    1   26   26   29                                       
CONECT   26    4   25   25   27                                       
CONECT   27   26   28   28   30                                       
CONECT   28   27   27   29   31                                       
CONECT   29    5    5   25   28                                       
CONECT   30   27   67   68   69                                       
CONECT   31   28   32   32   70                                       
CONECT   32   31   31   71   72                                       
CONECT   33    1   34   37                                            
CONECT   34    5   33   35   35                                       
CONECT   35   34   34   36   38                                       
CONECT   36   35   37   37   39                                       
CONECT   37    2   33   36   36                                       
CONECT   38   35   73   74   75                                       
CONECT   39   36   40   76   77                                       
CONECT   40   39   41   78   79                                       
CONECT   41   40   42   43   43                                       
CONECT   42   41   80                                                 
CONECT   43   41   41                                                 
CONECT   44    2   45   45   46                                       
CONECT   45   44   44   47   81                                       
CONECT   46   44   48   48   82                                       
CONECT   47   45   49   49   83                                       
CONECT   48   46   46   49   84                                       
CONECT   49   47   47   48   85                                       
CONECT   50    3                                                      
CONECT   51    4                                                      
CONECT   52    5                                                      
CONECT   53   11                                                      
CONECT   54   11                                                      
CONECT   55   12                                                      
CONECT   56   12                                                      
CONECT   57   15                                                      
CONECT   58   16                                                      
CONECT   59   16                                                      
CONECT   60   16                                                      
CONECT   61   22                                                      
CONECT   62   22                                                      
CONECT   63   22                                                      
CONECT   64   23                                                      
CONECT   65   24                                                      
CONECT   66   24                                                      
CONECT   67   30                                                      
CONECT   68   30                                                      
CONECT   69   30                                                      
CONECT   70   31                                                      
CONECT   71   32                                                      
CONECT   72   32                                                      
CONECT   73   38                                                      
CONECT   74   38                                                      
CONECT   75   38                                                      
CONECT   76   39                                                      
CONECT   77   39                                                      
CONECT   78   40                                                      
CONECT   79   40                                                      
CONECT   80   42                                                      
CONECT   81   45                                                      
CONECT   82   46                                                      
CONECT   83   47                                                      
CONECT   84   48                                                      
CONECT   85   49                                                      
MASTER        0    0    0    0    0    0    0    0   85    0   85    0
END
