COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.123  -2.842  -2.124  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.066  -0.677   0.143  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.115   2.546   1.260  1.00  0.00           C  
HETATM    4  C   UNL     1       3.147   0.321  -0.884  1.00  0.00           C  
HETATM    5  N   UNL     1      -1.224  -0.981  -1.381  1.00  0.00           N  
HETATM    6  C   UNL     1      -0.971  -2.054  -2.216  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.190  -2.178  -3.096  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.936  -1.532  -4.460  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.584  -3.647  -3.265  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.764  -4.278  -1.908  1.00  0.00           C  
HETATM   11  O   UNL     1      -3.013  -5.593  -1.807  1.00  0.00           O  
HETATM   12  O   UNL     1      -2.685  -3.599  -0.911  1.00  0.00           O  
HETATM   13  C   UNL     1      -3.780  -0.203  -3.136  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.944   0.469  -2.406  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.427   1.648  -3.209  1.00  0.00           C  
HETATM   16  O   UNL     1      -4.895   1.924  -4.258  1.00  0.00           O  
HETATM   17  O   UNL     1      -6.449   2.394  -2.759  1.00  0.00           O  
HETATM   18  C   UNL     1      -2.579  -0.939  -1.073  1.00  0.00           C  
HETATM   19  N   UNL     1      -0.938   0.239   1.015  1.00  0.00           N  
HETATM   20  C   UNL     1      -2.515   0.068   2.721  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.973   0.482   2.933  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.128  -1.075   3.661  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.916  -2.309   3.303  1.00  0.00           C  
HETATM   24  O   UNL     1      -2.671  -3.468   3.933  1.00  0.00           O  
HETATM   25  O   UNL     1      -3.768  -2.254   2.448  1.00  0.00           O  
HETATM   26  C   UNL     1      -1.466   2.138   4.118  1.00  0.00           C  
HETATM   27  C   UNL     1      -2.516   3.249   4.045  1.00  0.00           C  
HETATM   28  C   UNL     1      -2.416   4.116   5.273  1.00  0.00           C  
HETATM   29  O   UNL     1      -3.244   5.161   5.427  1.00  0.00           O  
HETATM   30  O   UNL     1      -1.590   3.871   6.120  1.00  0.00           O  
HETATM   31  C   UNL     1      -0.842   1.424   1.768  1.00  0.00           C  
HETATM   32  N   UNL     1       0.957   1.338  -0.553  1.00  0.00           N  
HETATM   33  C   UNL     1       0.680   2.507   0.133  1.00  0.00           C  
HETATM   34  C   UNL     1       1.474   3.463  -0.527  1.00  0.00           C  
HETATM   35  C   UNL     1       1.264   4.955  -0.524  1.00  0.00           C  
HETATM   36  C   UNL     1       0.275   5.326  -1.599  1.00  0.00           C  
HETATM   37  O   UNL     1      -0.068   6.610  -1.782  1.00  0.00           O  
HETATM   38  O   UNL     1      -0.209   4.466  -2.296  1.00  0.00           O  
HETATM   39  C   UNL     1       2.481   2.781  -1.179  1.00  0.00           C  
HETATM   40  C   UNL     1       3.576   3.391  -2.016  1.00  0.00           C  
HETATM   41  C   UNL     1       4.824   3.594  -1.153  1.00  0.00           C  
HETATM   42  C   UNL     1       5.919   4.204  -1.990  1.00  0.00           C  
HETATM   43  O   UNL     1       5.722   4.451  -3.156  1.00  0.00           O  
HETATM   44  O   UNL     1       7.113   4.473  -1.439  1.00  0.00           O  
HETATM   45  C   UNL     1       2.298   1.416  -0.920  1.00  0.00           C  
HETATM   46  N   UNL     1       1.380  -1.331  -0.641  1.00  0.00           N  
HETATM   47  C   UNL     1       2.723  -0.999  -0.639  1.00  0.00           C  
HETATM   48  C   UNL     1       3.303  -2.224  -0.400  1.00  0.00           C  
HETATM   49  C   UNL     1       4.680  -2.465   0.164  1.00  0.00           C  
HETATM   50  C   UNL     1       4.599  -2.546   1.690  1.00  0.00           C  
HETATM   51  C   UNL     1       5.975  -2.787   2.254  1.00  0.00           C  
HETATM   52  O   UNL     1       6.924  -2.885   1.512  1.00  0.00           O  
HETATM   53  O   UNL     1       6.148  -2.894   3.581  1.00  0.00           O  
HETATM   54  C   UNL     1       2.370  -3.212  -0.780  1.00  0.00           C  
HETATM   55  C   UNL     1       2.568  -4.704  -0.698  1.00  0.00           C  
HETATM   56  C   UNL     1       2.098  -5.200   0.645  1.00  0.00           C  
HETATM   57 CO   UNL     1       0.041  -0.175  -0.414  1.00  0.00          Co2+
HETATM   58  C   UNL     1      -1.566   1.271   2.889  1.00  0.00           C  
HETATM   59  O   UNL     1       2.179  -6.506   0.944  1.00  0.00           O  
HETATM   60  C   UNL     1      -2.260  -0.295   1.296  1.00  0.00           C  
HETATM   61  O   UNL     1       1.648  -4.422   1.453  1.00  0.00           O  
HETATM   62  C   UNL     1      -3.289  -1.401  -2.320  1.00  0.00           C  
HETATM   63  C   UNL     1       1.250  -2.568  -1.237  1.00  0.00           C  
HETATM   64  H   UNL     1       0.163  -3.729  -2.738  1.00  0.00           H  
HETATM   65  H   UNL     1      -4.134  -0.753   0.282  1.00  0.00           H  
HETATM   66  H   UNL     1      -2.653   0.714   1.421  1.00  0.00           H  
HETATM   67  H   UNL     1      -0.192   3.483   1.792  1.00  0.00           H  
HETATM   68  H   UNL     1       4.200   0.491  -1.054  1.00  0.00           H  
HETATM   69  H   UNL     1      -1.113  -2.045  -4.957  1.00  0.00           H  
HETATM   70  H   UNL     1      -2.835  -1.609  -5.071  1.00  0.00           H  
HETATM   71  H   UNL     1      -1.679  -0.481  -4.322  1.00  0.00           H  
HETATM   72  H   UNL     1      -3.518  -3.711  -3.823  1.00  0.00           H  
HETATM   73  H   UNL     1      -1.799  -4.173  -3.809  1.00  0.00           H  
HETATM   74  H   UNL     1      -4.121  -2.060  -2.070  1.00  0.00           H  
HETATM   75  H   UNL     1      -3.122  -5.952  -0.916  1.00  0.00           H  
HETATM   76  H   UNL     1      -4.113  -0.544  -4.116  1.00  0.00           H  
HETATM   77  H   UNL     1      -2.966   0.512  -3.257  1.00  0.00           H  
HETATM   78  H   UNL     1      -5.758  -0.246  -2.284  1.00  0.00           H  
HETATM   79  H   UNL     1      -4.610   0.809  -1.425  1.00  0.00           H  
HETATM   80  H   UNL     1      -6.724   3.140  -3.309  1.00  0.00           H  
HETATM   81  H   UNL     1      -4.113   0.802   3.965  1.00  0.00           H  
HETATM   82  H   UNL     1      -4.218   1.305   2.261  1.00  0.00           H  
HETATM   83  H   UNL     1      -4.625  -0.366   2.723  1.00  0.00           H  
HETATM   84  H   UNL     1      -1.062  -1.283   3.561  1.00  0.00           H  
HETATM   85  H   UNL     1      -2.347  -0.790   4.690  1.00  0.00           H  
HETATM   86  H   UNL     1      -3.202  -4.232   3.669  1.00  0.00           H  
HETATM   87  H   UNL     1      -0.472   2.581   4.170  1.00  0.00           H  
HETATM   88  H   UNL     1      -1.640   1.531   5.006  1.00  0.00           H  
HETATM   89  H   UNL     1      -2.342   3.856   3.157  1.00  0.00           H  
HETATM   90  H   UNL     1      -3.510   2.806   3.993  1.00  0.00           H  
HETATM   91  H   UNL     1      -3.142   5.688   6.231  1.00  0.00           H  
HETATM   92  H   UNL     1       0.878   5.265   0.447  1.00  0.00           H  
HETATM   93  H   UNL     1       2.213   5.456  -0.715  1.00  0.00           H  
HETATM   94  H   UNL     1      -0.706   6.799  -2.484  1.00  0.00           H  
HETATM   95  H   UNL     1       3.813   2.726  -2.846  1.00  0.00           H  
HETATM   96  H   UNL     1       3.243   4.353  -2.404  1.00  0.00           H  
HETATM   97  H   UNL     1       4.587   4.259  -0.323  1.00  0.00           H  
HETATM   98  H   UNL     1       5.157   2.632  -0.764  1.00  0.00           H  
HETATM   99  H   UNL     1       7.784   4.864  -2.015  1.00  0.00           H  
HETATM  100  H   UNL     1       5.074  -3.402  -0.229  1.00  0.00           H  
HETATM  101  H   UNL     1       5.339  -1.645  -0.122  1.00  0.00           H  
HETATM  102  H   UNL     1       4.204  -1.609   2.083  1.00  0.00           H  
HETATM  103  H   UNL     1       3.940  -3.366   1.976  1.00  0.00           H  
HETATM  104  H   UNL     1       7.049  -3.048   3.895  1.00  0.00           H  
HETATM  105  H   UNL     1       1.994  -5.191  -1.487  1.00  0.00           H  
HETATM  106  H   UNL     1       3.625  -4.937  -0.822  1.00  0.00           H  
HETATM  107  H   UNL     1       1.865  -6.777   1.818  1.00  0.00           H  
CONECT    1    6    6   63   64                                       
CONECT    2   18   18   60   65                                       
CONECT    3   31   33   33   67                                       
CONECT    4   45   45   47   68                                       
CONECT    5    6   18   57                                            
CONECT    6    1    1    5    7                                       
CONECT    7    6    8    9   62                                       
CONECT    8    7   69   70   71                                       
CONECT    9    7   10   72   73                                       
CONECT   10    9   12   12   11                                       
CONECT   11   10   75                                                 
CONECT   12   10   10                                                 
CONECT   13   14   62   76   77                                       
CONECT   14   13   15   78   79                                       
CONECT   15   14   16   16   17                                       
CONECT   16   15   15                                                 
CONECT   17   15   80                                                 
CONECT   18    2    2    5   62                                       
CONECT   19   31   57   60                                            
CONECT   20   21   22   58   60                                       
CONECT   21   20   81   82   83                                       
CONECT   22   20   23   84   85                                       
CONECT   23   22   24   25   25                                       
CONECT   24   23   86                                                 
CONECT   25   23   23                                                 
CONECT   26   27   58   87   88                                       
CONECT   27   26   28   89   90                                       
CONECT   28   27   29   30   30                                       
CONECT   29   28   91                                                 
CONECT   30   28   28                                                 
CONECT   31    3   19   58   58                                       
CONECT   32   33   45   57                                            
CONECT   33    3    3   32   34                                       
CONECT   34   33   35   39   39                                       
CONECT   35   34   36   92   93                                       
CONECT   36   35   37   38   38                                       
CONECT   37   36   94                                                 
CONECT   38   36   36                                                 
CONECT   39   34   34   40   45                                       
CONECT   40   39   41   95   96                                       
CONECT   41   40   42   97   98                                       
CONECT   42   41   43   43   44                                       
CONECT   43   42   42                                                 
CONECT   44   42   99                                                 
CONECT   45    4    4   32   39                                       
CONECT   46   47   63   57                                            
CONECT   47    4   46   48   48                                       
CONECT   48   47   47   49   54                                       
CONECT   49   48   50  100  101                                       
CONECT   50   49   51  102  103                                       
CONECT   51   50   52   52   53                                       
CONECT   52   51   51                                                 
CONECT   53   51  104                                                 
CONECT   54   48   55   63   63                                       
CONECT   55   54   56  105  106                                       
CONECT   56   55   61   61   59                                       
CONECT   57    5   19   32   46                                       
CONECT   58   20   26   31   31                                       
CONECT   59   56  107                                                 
CONECT   60    2   19   20   66                                       
CONECT   61   56   56                                                 
CONECT   62    7   13   18   74                                       
CONECT   63    1   46   54   54                                       
CONECT   64    1                                                      
CONECT   65    2                                                      
CONECT   66   60                                                      
CONECT   67    3                                                      
CONECT   68    4                                                      
CONECT   69    8                                                      
CONECT   70    8                                                      
CONECT   71    8                                                      
CONECT   72    9                                                      
CONECT   73    9                                                      
CONECT   74   62                                                      
CONECT   75   11                                                      
CONECT   76   13                                                      
CONECT   77   13                                                      
CONECT   78   14                                                      
CONECT   79   14                                                      
CONECT   80   17                                                      
CONECT   81   21                                                      
CONECT   82   21                                                      
CONECT   83   21                                                      
CONECT   84   22                                                      
CONECT   85   22                                                      
CONECT   86   24                                                      
CONECT   87   26                                                      
CONECT   88   26                                                      
CONECT   89   27                                                      
CONECT   90   27                                                      
CONECT   91   29                                                      
CONECT   92   35                                                      
CONECT   93   35                                                      
CONECT   94   37                                                      
CONECT   95   40                                                      
CONECT   96   40                                                      
CONECT   97   41                                                      
CONECT   98   41                                                      
CONECT   99   44                                                      
CONECT  100   49                                                      
CONECT  101   49                                                      
CONECT  102   50                                                      
CONECT  103   50                                                      
CONECT  104   53                                                      
CONECT  105   55                                                      
CONECT  106   55                                                      
CONECT  107   59                                                      
MASTER        0    0    0    0    0    0    0    0  107    0  107    0
END
