COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -5.500 -22.093 -29.162  1.00  0.00           O  
HETATM    2 FE   UNL     1      -7.454 -21.465 -27.091  1.00  0.00          Fe2+
HETATM    3  C   UNL     1      -8.472 -22.740 -27.937  1.00  0.00           C  
HETATM    4  O   UNL     1      -9.135 -23.572 -28.469  1.00  0.00           O1+
HETATM    5  C   UNL     1      -7.741 -22.204 -25.416  1.00  0.00           C  
HETATM    6  O   UNL     1      -7.954 -22.678 -24.330  1.00  0.00           O1+
HETATM    7  C   UNL     1      -8.767 -19.999 -27.337  1.00  0.00           C  
HETATM    8  O   UNL     1      -9.575 -20.002 -26.165  1.00  0.00           O  
HETATM    9  C   UNL     1      -8.901 -19.039 -28.461  1.00  0.00           C  
HETATM   10  C   UNL     1      -7.809 -19.540 -29.360  1.00  0.00           C  
HETATM   11  N   UNL     1      -7.118 -20.595 -28.934  1.00  0.00           N  
HETATM   12  C   UNL     1      -7.575 -18.924 -30.583  1.00  0.00           C  
HETATM   13  C   UNL     1      -8.394 -17.729 -31.023  1.00  0.00           C  
HETATM   14  C   UNL     1      -6.568 -19.413 -31.385  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.797 -20.508 -30.928  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.672 -21.114 -31.736  1.00  0.00           C  
HETATM   17  C   UNL     1      -6.152 -21.039 -29.683  1.00  0.00           C  
HETATM   18  O   UNL     1      -6.327 -18.795 -32.584  1.00  0.00           O  
HETATM   19  P   UNL     1      -6.721 -19.402 -34.019  1.00  0.00           P  
HETATM   20  O   UNL     1      -5.601 -19.114 -35.020  1.00  0.00           O  
HETATM   21  O   UNL     1      -7.240 -20.823 -33.863  1.00  0.00           O  
HETATM   22  O   UNL     1      -8.018 -18.512 -34.299  1.00  0.00           O  
HETATM   23  C   UNL     1      -7.896 -17.144 -34.708  1.00  0.00           C  
HETATM   24  C   UNL     1      -8.850 -16.936 -35.885  1.00  0.00           C  
HETATM   25  O   UNL     1      -9.034 -15.548 -36.125  1.00  0.00           O  
HETATM   26  C   UNL     1      -9.271 -15.379 -37.518  1.00  0.00           C  
HETATM   27  C   UNL     1      -8.294 -16.337 -38.152  1.00  0.00           C  
HETATM   28  O   UNL     1      -8.782 -16.668 -39.452  1.00  0.00           O  
HETATM   29  C   UNL     1      -8.336 -17.504 -37.188  1.00  0.00           C  
HETATM   30  O   UNL     1      -9.345 -18.422 -37.597  1.00  0.00           O  
HETATM   31  N   UNL     1      -9.141 -13.953 -37.915  1.00  0.00           N  
HETATM   32  C   UNL     1     -10.179 -13.128 -38.051  1.00  0.00           C  
HETATM   33  N   UNL     1     -11.523 -13.294 -37.920  1.00  0.00           N  
HETATM   34  C   UNL     1     -12.391 -12.295 -38.153  1.00  0.00           C  
HETATM   35  N   UNL     1     -13.724 -12.554 -37.998  1.00  0.00           N  
HETATM   36  N   UNL     1     -11.937 -11.062 -38.509  1.00  0.00           N  
HETATM   37  C   UNL     1     -10.595 -10.839 -38.647  1.00  0.00           C  
HETATM   38  O   UNL     1     -10.117  -9.608 -38.995  1.00  0.00           O  
HETATM   39  C   UNL     1      -9.688 -11.887 -38.426  1.00  0.00           C  
HETATM   40  N   UNL     1      -8.349 -12.002 -38.487  1.00  0.00           N  
HETATM   41  C   UNL     1      -8.019 -13.267 -38.169  1.00  0.00           C  
HETATM   42  H   UNL     1      -8.721 -18.003 -28.137  1.00  0.00           H  
HETATM   43  H   UNL     1      -9.143 -17.493 -30.252  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.731 -16.863 -31.167  1.00  0.00           H  
HETATM   45  H   UNL     1      -8.904 -17.962 -31.970  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.225 -21.948 -31.175  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.067 -21.486 -32.693  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.905 -20.349 -31.928  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.768 -21.400 -34.452  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.862 -16.935 -35.020  1.00  0.00           H  
HETATM   51  H   UNL     1      -8.171 -16.477 -33.878  1.00  0.00           H  
HETATM   52  H   UNL     1      -9.813 -17.410 -35.645  1.00  0.00           H  
HETATM   53  H   UNL     1     -10.290 -15.717 -37.758  1.00  0.00           H  
HETATM   54  H   UNL     1      -7.286 -15.899 -38.189  1.00  0.00           H  
HETATM   55  H   UNL     1      -8.181 -17.272 -39.872  1.00  0.00           H  
HETATM   56  H   UNL     1      -7.347 -17.971 -37.069  1.00  0.00           H  
HETATM   57  H   UNL     1      -9.372 -19.154 -36.992  1.00  0.00           H  
HETATM   58  H   UNL     1     -14.027 -13.465 -37.719  1.00  0.00           H  
HETATM   59  H   UNL     1     -14.396 -11.832 -38.164  1.00  0.00           H  
HETATM   60  H   UNL     1     -12.586 -10.318 -38.670  1.00  0.00           H  
HETATM   61  H   UNL     1      -7.015 -13.664 -38.126  1.00  0.00           H  
HETATM   62  H   UNL     1      -9.889 -19.107 -28.941  1.00  0.00           H  
HETATM   63  O   UNL     1       0.000   0.000   0.000  1.00  0.00           O  
HETATM   64  S   UNL     1       0.000   0.000   0.000  1.00  0.00           S  
HETATM   65  H   UNL     1       0.000   0.000   0.000  1.00  0.00           H  
HETATM   66  H   UNL     1       0.000   0.000   0.000  1.00  0.00           H  
CONECT    1   17   17                                                 
CONECT    2   11    3    7    5                                       
CONECT    2   63   64                                                 
CONECT    3    4    4    4    2                                       
CONECT    4    3    3    3                                            
CONECT    5    2    6    6    6                                       
CONECT    6    5    5    5                                            
CONECT    7    9    2    8    8                                       
CONECT    8    7    7                                                 
CONECT    9   10    7   42   62                                       
CONECT   10   12   12   11    9                                       
CONECT   11   17   10    2                                            
CONECT   12   14   13   10   10                                       
CONECT   13   12   43   44   45                                       
CONECT   14   18   15   15   12                                       
CONECT   15   16   14   14   17                                       
CONECT   16   15   46   47   48                                       
CONECT   17   15    1    1   11                                       
CONECT   18   19   14                                                 
CONECT   19   20   20   22   21                                       
CONECT   19   18                                                      
CONECT   20   19   19                                                 
CONECT   21   19   49                                                 
CONECT   22   23   19                                                 
CONECT   23   24   22   50   51                                       
CONECT   24   29   25   23   52                                       
CONECT   25   26   24                                                 
CONECT   26   27   31   25   53                                       
CONECT   27   28   26   29   54                                       
CONECT   28   27   55                                                 
CONECT   29   27   30   24   56                                       
CONECT   30   29   57                                                 
CONECT   31   41   32   26                                            
CONECT   32   39   39   33   31                                       
CONECT   33   34   34   32                                            
CONECT   34   36   35   33   33                                       
CONECT   35   34   58   59                                            
CONECT   36   37   34   60                                            
CONECT   37   38   38   36   39                                       
CONECT   38   37   37                                                 
CONECT   39   37   40   32   32                                       
CONECT   40   39   41   41                                            
CONECT   41   40   40   31   61                                       
CONECT   42    9                                                      
CONECT   43   13                                                      
CONECT   44   13                                                      
CONECT   45   13                                                      
CONECT   46   16                                                      
CONECT   47   16                                                      
CONECT   48   16                                                      
CONECT   49   21                                                      
CONECT   50   23                                                      
CONECT   51   23                                                      
CONECT   52   24                                                      
CONECT   53   26                                                      
CONECT   54   27                                                      
CONECT   55   28                                                      
CONECT   56   29                                                      
CONECT   57   30                                                      
CONECT   58   35                                                      
CONECT   59   35                                                      
CONECT   60   36                                                      
CONECT   61   41                                                      
CONECT   62    9                                                      
CONECT   63    2   66                                                 
CONECT   64    2   65                                                 
CONECT   65   64                                                      
CONECT   66   63                                                      
MASTER        0    0    0    0    0    0    0    0   66    0   66    0
END
