COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1 MN   UNL     1      21.142  45.562 185.604  1.00  0.00          Mn2+
HETATM    2  C   UNL     1      22.950  44.536 183.165  1.00  0.00           C  
HETATM    3  C   UNL     1      20.040  47.997 183.673  1.00  0.00           C  
HETATM    4  C   UNL     1      19.997  47.351 188.227  1.00  0.00           C  
HETATM    5  C   UNL     1      22.856  43.849 187.610  1.00  0.00           C  
HETATM    6  N   UNL     1      21.455  46.204 183.623  1.00  0.00           N  
HETATM    7  C   UNL     1      22.160  45.541 182.650  1.00  0.00           C  
HETATM    8  C   UNL     1      21.784  46.013 181.328  1.00  0.00           C  
HETATM    9  C   UNL     1      20.964  47.076 181.447  1.00  0.00           C  
HETATM   10  C   UNL     1      20.783  47.155 182.889  1.00  0.00           C  
HETATM   11  C   UNL     1      20.269  47.975 180.434  1.00  0.00           C  
HETATM   12  C   UNL     1      22.354  45.346 180.075  1.00  0.00           C  
HETATM   13  C   UNL     1      21.341  44.366 179.487  1.00  0.00           C  
HETATM   14  C   UNL     1      21.500  43.792 178.083  1.00  0.00           C  
HETATM   15  O   UNL     1      22.585  43.825 177.468  1.00  0.00           O  
HETATM   16  O   UNL     1      20.476  43.174 177.723  1.00  0.00           O  
HETATM   17  N   UNL     1      20.116  47.510 185.919  1.00  0.00           N1+
HETATM   18  C   UNL     1      19.679  48.410 184.945  1.00  0.00           C  
HETATM   19  C   UNL     1      18.798  49.472 185.366  1.00  0.00           C  
HETATM   20  C   UNL     1      18.814  49.204 186.722  1.00  0.00           C  
HETATM   21  C   UNL     1      19.604  48.039 187.095  1.00  0.00           C  
HETATM   22  C   UNL     1      18.159  50.469 184.373  1.00  0.00           C  
HETATM   23  C   UNL     1      18.020  50.049 187.715  1.00  0.00           C  
HETATM   24  C   UNL     1      17.651  51.464 188.128  1.00  0.00           C  
HETATM   25  N   UNL     1      21.420  45.587 187.746  1.00  0.00           N  
HETATM   26  C   UNL     1      20.778  46.323 188.718  1.00  0.00           C  
HETATM   27  C   UNL     1      21.044  45.804 190.051  1.00  0.00           C  
HETATM   28  C   UNL     1      21.881  44.769 189.878  1.00  0.00           C  
HETATM   29  C   UNL     1      22.149  44.667 188.459  1.00  0.00           C  
HETATM   30  C   UNL     1      20.386  46.337 191.328  1.00  0.00           C  
HETATM   31  C   UNL     1      22.388  43.802 190.937  1.00  0.00           C  
HETATM   32  C   UNL     1      23.811  43.511 191.361  1.00  0.00           C  
HETATM   33  N   UNL     1      22.822  44.333 185.444  1.00  0.00           N1+
HETATM   34  C   UNL     1      23.362  43.496 186.393  1.00  0.00           C  
HETATM   35  C   UNL     1      24.383  42.583 185.900  1.00  0.00           C  
HETATM   36  C   UNL     1      24.393  42.866 184.569  1.00  0.00           C  
HETATM   37  C   UNL     1      23.444  43.913 184.299  1.00  0.00           C  
HETATM   38  C   UNL     1      25.168  41.571 186.738  1.00  0.00           C  
HETATM   39  C   UNL     1      25.216  42.184 183.479  1.00  0.00           C  
HETATM   40  C   UNL     1      26.577  42.826 183.264  1.00  0.00           C  
HETATM   41  C   UNL     1      27.327  42.396 182.026  1.00  0.00           C  
HETATM   42  O   UNL     1      27.247  41.250 181.554  1.00  0.00           O  
HETATM   43  O   UNL     1      27.926  43.306 181.404  1.00  0.00           O  
HETATM   44  H   UNL     1      23.361  44.005 182.319  1.00  0.00           H  
HETATM   45  H   UNL     1      19.484  48.622 182.990  1.00  0.00           H  
HETATM   46  H   UNL     1      19.487  47.798 189.068  1.00  0.00           H  
HETATM   47  H   UNL     1      23.195  43.054 188.258  1.00  0.00           H  
HETATM   48  H   UNL     1      19.302  47.531 180.153  1.00  0.00           H  
HETATM   49  H   UNL     1      20.901  48.076 179.539  1.00  0.00           H  
HETATM   50  H   UNL     1      20.101  48.967 180.878  1.00  0.00           H  
HETATM   51  H   UNL     1      23.267  44.796 180.346  1.00  0.00           H  
HETATM   52  H   UNL     1      22.585  46.119 179.327  1.00  0.00           H  
HETATM   53  H   UNL     1      20.435  44.982 179.394  1.00  0.00           H  
HETATM   54  H   UNL     1      21.344  43.498 180.163  1.00  0.00           H  
HETATM   55  H   UNL     1      22.517  43.305 176.676  1.00  0.00           H  
HETATM   56  H   UNL     1      17.190  50.076 184.032  1.00  0.00           H  
HETATM   57  H   UNL     1      18.825  50.603 183.508  1.00  0.00           H  
HETATM   58  H   UNL     1      18.007  51.438 184.872  1.00  0.00           H  
HETATM   59  H   UNL     1      17.523  49.372 188.394  1.00  0.00           H  
HETATM   60  H   UNL     1      18.012  52.344 187.617  1.00  0.00           H  
HETATM   61  H   UNL     1      16.992  51.504 188.983  1.00  0.00           H  
HETATM   62  H   UNL     1      19.625  45.622 191.674  1.00  0.00           H  
HETATM   63  H   UNL     1      19.911  47.307 191.118  1.00  0.00           H  
HETATM   64  H   UNL     1      21.150  46.465 192.109  1.00  0.00           H  
HETATM   65  H   UNL     1      21.625  43.245 191.460  1.00  0.00           H  
HETATM   66  H   UNL     1      24.701  43.968 190.954  1.00  0.00           H  
HETATM   67  H   UNL     1      23.779  42.766 192.142  1.00  0.00           H  
HETATM   68  H   UNL     1      24.585  41.305 187.632  1.00  0.00           H  
HETATM   69  H   UNL     1      26.127  42.014 187.044  1.00  0.00           H  
HETATM   70  H   UNL     1      25.356  40.667 186.140  1.00  0.00           H  
HETATM   71  H   UNL     1      24.656  42.279 182.537  1.00  0.00           H  
HETATM   72  H   UNL     1      25.373  41.135 183.772  1.00  0.00           H  
HETATM   73  H   UNL     1      27.196  42.506 184.115  1.00  0.00           H  
HETATM   74  H   UNL     1      26.419  43.912 183.190  1.00  0.00           H  
HETATM   75  H   UNL     1      28.265  42.961 180.586  1.00  0.00           H  
CONECT    1    6   17   25   33                                       
CONECT    2    7    7   37   44                                       
CONECT    3   10   10   18   45                                       
CONECT    4   21   21   26   46                                       
CONECT    5   29   34   34   47                                       
CONECT    6    1    7   10                                            
CONECT    7    2    2    6    8                                       
CONECT    8    7    9    9   12                                       
CONECT    9    8    8   10   11                                       
CONECT   10    3    3    6    9                                       
CONECT   11    9   48   49   50                                       
CONECT   12    8   13   51   52                                       
CONECT   13   12   14   53   54                                       
CONECT   14   13   15   16   16                                       
CONECT   15   14   55                                                 
CONECT   16   14   14                                                 
CONECT   17    1   18   18   21                                       
CONECT   18    3   17   17   19                                       
CONECT   19   18   20   20   22                                       
CONECT   20   19   19   21   23                                       
CONECT   21    4    4   17   20                                       
CONECT   22   19   56   57   58                                       
CONECT   23   20   24   24   59                                       
CONECT   24   23   23   60   61                                       
CONECT   25    1   26   29                                            
CONECT   26    4   25   27   27                                       
CONECT   27   26   26   28   30                                       
CONECT   28   27   29   29   31                                       
CONECT   29    5   25   28   28                                       
CONECT   30   27   62   63   64                                       
CONECT   31   28   32   32   65                                       
CONECT   32   31   31   66   67                                       
CONECT   33    1   34   37   37                                       
CONECT   34    5    5   33   35                                       
CONECT   35   34   36   36   38                                       
CONECT   36   35   35   37   39                                       
CONECT   37    2   33   33   36                                       
CONECT   38   35   68   69   70                                       
CONECT   39   36   40   71   72                                       
CONECT   40   39   41   73   74                                       
CONECT   41   40   42   42   43                                       
CONECT   42   41   41                                                 
CONECT   43   41   75                                                 
CONECT   44    2                                                      
CONECT   45    3                                                      
CONECT   46    4                                                      
CONECT   47    5                                                      
CONECT   48   11                                                      
CONECT   49   11                                                      
CONECT   50   11                                                      
CONECT   51   12                                                      
CONECT   52   12                                                      
CONECT   53   13                                                      
CONECT   54   13                                                      
CONECT   55   15                                                      
CONECT   56   22                                                      
CONECT   57   22                                                      
CONECT   58   22                                                      
CONECT   59   23                                                      
CONECT   60   24                                                      
CONECT   61   24                                                      
CONECT   62   30                                                      
CONECT   63   30                                                      
CONECT   64   30                                                      
CONECT   65   31                                                      
CONECT   66   32                                                      
CONECT   67   32                                                      
CONECT   68   38                                                      
CONECT   69   38                                                      
CONECT   70   38                                                      
CONECT   71   39                                                      
CONECT   72   39                                                      
CONECT   73   40                                                      
CONECT   74   40                                                      
CONECT   75   43                                                      
MASTER        0    0    0    0    0    0    0    0   75    0   75    0
END
