COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      36.673 -43.511  -2.573  1.00  0.00           C  
HETATM    2  C   UNL     1      37.593 -43.116  -1.691  1.00  0.00           C  
HETATM    3  C   UNL     1      38.026 -41.877  -1.991  1.00  0.00           C  
HETATM    4  N   UNL     1      37.305 -41.575  -3.081  1.00  0.00           N  
HETATM    5  C   UNL     1      36.464 -42.543  -3.477  1.00  0.00           C  
HETATM    6  C   UNL     1      35.638 -42.516  -4.573  1.00  0.00           C  
HETATM    7  C   UNL     1      34.918 -43.768  -4.802  1.00  0.00           C  
HETATM    8  C   UNL     1      34.475 -44.535  -4.940  1.00  0.00           C  
HETATM    9  C   UNL     1      35.405 -41.576  -5.547  1.00  0.00           C  
HETATM   10  N   UNL     1      35.915 -40.347  -5.612  1.00  0.00           N  
HETATM   11  C   UNL     1      34.658 -41.648  -6.656  1.00  0.00           C  
HETATM   12  C   UNL     1      34.720 -40.502  -7.327  1.00  0.00           C  
HETATM   13  C   UNL     1      35.531 -39.641  -6.686  1.00  0.00           C  
HETATM   14  C   UNL     1      35.882 -38.328  -6.973  1.00  0.00           C  
HETATM   15  C   UNL     1      35.208 -37.750  -8.080  1.00  0.00           C  
HETATM   16  C   UNL     1      35.922 -37.326  -9.207  1.00  0.00           C  
HETATM   17  C   UNL     1      35.268 -36.752 -10.304  1.00  0.00           C  
HETATM   18  C   UNL     1      33.881 -36.600 -10.291  1.00  0.00           C  
HETATM   19  C   UNL     1      33.155 -37.028  -9.175  1.00  0.00           C  
HETATM   20  C   UNL     1      33.814 -37.586  -8.077  1.00  0.00           C  
HETATM   21  C   UNL     1      36.745 -37.483  -6.296  1.00  0.00           C  
HETATM   22  N   UNL     1      37.533 -37.823  -5.265  1.00  0.00           N  
HETATM   23  C   UNL     1      37.013 -36.174  -6.458  1.00  0.00           C  
HETATM   24  C   UNL     1      37.927 -35.776  -5.565  1.00  0.00           C  
HETATM   25  C   UNL     1      38.281 -36.810  -4.786  1.00  0.00           C  
HETATM   26  C   UNL     1      39.192 -36.870  -3.751  1.00  0.00           C  
HETATM   27  C   UNL     1      40.106 -35.671  -3.665  1.00  0.00           C  
HETATM   28  C   UNL     1      40.700 -34.903  -3.610  1.00  0.00           C  
HETATM   29  C   UNL     1      39.408 -37.805  -2.767  1.00  0.00           C  
HETATM   30  N   UNL     1      38.935 -39.058  -2.744  1.00  0.00           N  
HETATM   31  C   UNL     1      40.121 -37.728  -1.634  1.00  0.00           C  
HETATM   32  C   UNL     1      40.053 -38.881  -0.976  1.00  0.00           C  
HETATM   33  C   UNL     1      39.304 -39.756  -1.664  1.00  0.00           C  
HETATM   34  C   UNL     1      38.964 -41.060  -1.384  1.00  0.00           C  
HETATM   35  C   UNL     1      39.642 -41.579  -0.259  1.00  0.00           C  
HETATM   36  C   UNL     1      38.936 -41.793   0.921  1.00  0.00           C  
HETATM   37  C   UNL     1      39.562 -42.289   2.063  1.00  0.00           C  
HETATM   38  C   UNL     1      40.921 -42.559   2.040  1.00  0.00           C  
HETATM   39  C   UNL     1      41.644 -42.336   0.866  1.00  0.00           C  
HETATM   40  C   UNL     1      41.010 -41.848  -0.277  1.00  0.00           C  
HETATM   41 FE   UNL     1      37.365 -39.642  -4.099  1.00  0.00          Fe  
HETATM   42  H   UNL     1      36.172 -44.467  -2.561  1.00  0.00           H  
HETATM   43  H   UNL     1      37.941 -43.706  -0.856  1.00  0.00           H  
HETATM   44  H   UNL     1      33.951 -45.442  -5.103  1.00  0.00           H  
HETATM   45  H   UNL     1      34.087 -42.513  -6.961  1.00  0.00           H  
HETATM   46  H   UNL     1      34.197 -40.293  -8.249  1.00  0.00           H  
HETATM   47  H   UNL     1      36.995 -37.444  -9.231  1.00  0.00           H  
HETATM   48  H   UNL     1      35.838 -36.426 -11.162  1.00  0.00           H  
HETATM   49  H   UNL     1      33.373 -36.156 -11.135  1.00  0.00           H  
HETATM   50  H   UNL     1      32.080 -36.927  -9.162  1.00  0.00           H  
HETATM   51  H   UNL     1      33.243 -37.895  -7.214  1.00  0.00           H  
HETATM   52  H   UNL     1      36.557 -35.537  -7.201  1.00  0.00           H  
HETATM   53  H   UNL     1      38.321 -34.774  -5.484  1.00  0.00           H  
HETATM   54  H   UNL     1      41.347 -34.066  -3.550  1.00  0.00           H  
HETATM   55  H   UNL     1      40.669 -36.858  -1.305  1.00  0.00           H  
HETATM   56  H   UNL     1      40.530 -39.083  -0.028  1.00  0.00           H  
HETATM   57  H   UNL     1      37.880 -41.570   0.952  1.00  0.00           H  
HETATM   58  H   UNL     1      38.990 -42.462   2.963  1.00  0.00           H  
HETATM   59  H   UNL     1      41.416 -42.938   2.922  1.00  0.00           H  
HETATM   60  H   UNL     1      42.704 -42.543   0.843  1.00  0.00           H  
HETATM   61  H   UNL     1      41.580 -41.678  -1.178  1.00  0.00           H  
CONECT    1    5    2    2   42                                       
CONECT    2    1    1    3   43                                       
CONECT    3    4    2   34   34                                       
CONECT    4   41    5    5    3                                       
CONECT    5    6    4    4    1                                       
CONECT    6    9    9    7    5                                       
CONECT    7    8    8    8    6                                       
CONECT    8    7    7    7   44                                       
CONECT    9   11   10    6    6                                       
CONECT   10   13    9   41                                            
CONECT   11   12   12    9   45                                       
CONECT   12   13   11   11   46                                       
CONECT   13   12   14   14   10                                       
CONECT   14   15   13   13   21                                       
CONECT   15   16   16   20   14                                       
CONECT   16   17   15   15   47                                       
CONECT   17   18   18   16   48                                       
CONECT   18   17   17   19   49                                       
CONECT   19   18   20   20   50                                       
CONECT   20   19   19   15   51                                       
CONECT   21   14   23   22   22                                       
CONECT   22   21   21   25   41                                       
CONECT   23   21   24   24   52                                       
CONECT   24   23   23   25   53                                       
CONECT   25   24   22   26   26                                       
CONECT   26   25   25   27   29                                       
CONECT   27   26   28   28   28                                       
CONECT   28   27   27   27   54                                       
CONECT   29   26   30   31   31                                       
CONECT   30   41   29   33                                            
CONECT   31   29   29   32   55                                       
CONECT   32   33   33   31   56                                       
CONECT   33   30   34   32   32                                       
CONECT   34    3    3   33   35                                       
CONECT   35   34   40   40   36                                       
CONECT   36   35   37   37   57                                       
CONECT   37   36   36   38   58                                       
CONECT   38   39   39   37   59                                       
CONECT   39   40   38   38   60                                       
CONECT   40   35   35   39   61                                       
CONECT   41   10   22    4   30                                       
CONECT   42    1                                                      
CONECT   43    2                                                      
CONECT   44    8                                                      
CONECT   45   11                                                      
CONECT   46   12                                                      
CONECT   47   16                                                      
CONECT   48   17                                                      
CONECT   49   18                                                      
CONECT   50   19                                                      
CONECT   51   20                                                      
CONECT   52   23                                                      
CONECT   53   24                                                      
CONECT   54   28                                                      
CONECT   55   31                                                      
CONECT   56   32                                                      
CONECT   57   36                                                      
CONECT   58   37                                                      
CONECT   59   38                                                      
CONECT   60   39                                                      
CONECT   61   40                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
