COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.0.0
HETATM    1  C   UNK A   2       0.499   1.103   3.471  1.00  0.00           C  
HETATM    2  C   UNK A   2      -0.142   0.294   2.341  1.00  0.00           C  
HETATM    3  C   UNK A   2       0.743   0.370   1.095  1.00  0.00           C  
HETATM    4  C   UNK A   2      -0.286  -1.165   2.776  1.00  0.00           C  
HETATM    5  C   UNK A   2      -0.520  -2.043   1.545  1.00  0.00           C  
HETATM    6  C   UNK A   2      -1.596  -1.433   0.675  1.00  0.00           C  
HETATM    7  C   UNK A   2      -3.520  -0.497   0.019  1.00  0.00           C  
HETATM    8  C   UNK A   2      -4.789   0.068  -0.089  1.00  0.00           C  
HETATM    9  C   UNK A   2      -5.197   0.455  -1.358  1.00  0.00           C  
HETATM   10  C   UNK A   2      -7.275   1.039  -0.361  1.00  0.00           C  
HETATM   11  C   UNK A   2      -8.757   1.120  -0.784  1.00  0.00           C  
HETATM   12  C   UNK A   2      -9.453   2.045   0.229  1.00  0.00           C  
HETATM   13  C   UNK A   2      -8.371   2.494   1.232  1.00  0.00           C  
HETATM   14  C   UNK A   2      -7.039   2.334   0.455  1.00  0.00           C  
HETATM   15  C   UNK A   2      -4.389   0.293  -2.477  1.00  0.00           C  
HETATM   16  C   UNK A   2      -3.135  -0.260  -2.395  1.00  0.00           C  
HETATM   17  C   UNK A   2      -2.700  -0.657  -1.127  1.00  0.00           C  
HETATM   18  C   UNK A   2      -1.468  -1.261  -0.658  1.00  0.00           C  
HETATM   19  C   UNK A   2      -0.248  -1.637  -1.458  1.00  0.00           C  
HETATM   20  C   UNK A   2       0.606  -2.612  -0.635  1.00  0.00           C  
HETATM   21  C   UNK A   2       1.944  -2.775  -1.281  1.00  0.00           C  
HETATM   22  C   UNK A   1       3.197  -1.817   0.603  1.00  0.00           C  
HETATM   23  C   UNK A   1       3.786  -0.411   0.470  1.00  0.00           C  
HETATM   24  C   UNK A   1       5.221  -0.506  -0.049  1.00  0.00           C  
HETATM   25  C   UNK A   1       5.801   0.879  -0.181  1.00  0.00           C  
HETATM   26  C   UNK A   1       7.551   2.403  -0.723  1.00  0.00           C  
HETATM   27  C   UNK A   1       8.991   2.388  -1.240  1.00  0.00           C  
HETATM   28  C   UNK A   1       7.511   3.064   0.656  1.00  0.00           C  
HETATM   29  C   UNK A   1       6.670   3.193  -1.693  1.00  0.00           C  
HETATM   30  C   UNK A   1       1.869  -1.725   1.281  1.00  0.00           C  
HETATM   31  N   UNK A   2      -2.821  -0.977   1.089  1.00  0.00           N  
HETATM   32  N   UNK A   1       3.095  -2.413  -0.718  1.00  0.00           N  
HETATM   33  N   UNK A   2       0.715  -2.115   0.736  1.00  0.00           N  
HETATM   34  O   UNK A   2      -6.428   1.011  -1.512  1.00  0.00           O  
HETATM   35  O   UNK A   2       1.983  -3.269  -2.388  1.00  0.00           O  
HETATM   36  O   UNK A   1       5.134   1.843   0.111  1.00  0.00           O  
HETATM   37  O   UNK A   1       7.058   1.041  -0.622  1.00  0.00           O  
HETATM   38  O   UNK A   1       1.838  -1.266   2.404  1.00  0.00           O  
HETATM   39  H   UNK A   2       0.601   2.143   3.161  1.00  0.00           H  
HETATM   40  H   UNK A   2      -0.132   1.049   4.359  1.00  0.00           H  
HETATM   41  H   UNK A   2       1.483   0.692   3.698  1.00  0.00           H  
HETATM   42  H   UNK A   2      -1.126   0.705   2.113  1.00  0.00           H  
HETATM   43  H   UNK A   2       0.619   1.344   0.621  1.00  0.00           H  
HETATM   44  H   UNK A   2       1.786   0.235   1.381  1.00  0.00           H  
HETATM   45  H   UNK A   2       0.453  -0.414   0.395  1.00  0.00           H  
HETATM   46  H   UNK A   2       0.624  -1.485   3.283  1.00  0.00           H  
HETATM   47  H   UNK A   2      -1.133  -1.260   3.456  1.00  0.00           H  
HETATM   48  H   UNK A   2      -0.818  -3.045   1.856  1.00  0.00           H  
HETATM   49  H   UNK A   2      -5.425   0.198   0.774  1.00  0.00           H  
HETATM   50  H   UNK A   2      -7.103   0.160   0.260  1.00  0.00           H  
HETATM   51  H   UNK A   2      -8.837   1.538  -1.787  1.00  0.00           H  
HETATM   52  H   UNK A   2      -9.208   0.127  -0.756  1.00  0.00           H  
HETATM   53  H   UNK A   2      -9.871   2.912  -0.282  1.00  0.00           H  
HETATM   54  H   UNK A   2     -10.243   1.502   0.749  1.00  0.00           H  
HETATM   55  H   UNK A   2      -8.524   3.535   1.518  1.00  0.00           H  
HETATM   56  H   UNK A   2      -8.376   1.851   2.113  1.00  0.00           H  
HETATM   57  H   UNK A   2      -6.202   2.214   1.143  1.00  0.00           H  
HETATM   58  H   UNK A   2      -6.876   3.183  -0.210  1.00  0.00           H  
HETATM   59  H   UNK A   2      -4.758   0.612  -3.440  1.00  0.00           H  
HETATM   60  H   UNK A   2      -2.514  -0.383  -3.270  1.00  0.00           H  
HETATM   61  H   UNK A   2      -0.555  -2.116  -2.388  1.00  0.00           H  
HETATM   62  H   UNK A   2       0.333  -0.742  -1.681  1.00  0.00           H  
HETATM   63  H   UNK A   2       0.107  -3.580  -0.608  1.00  0.00           H  
HETATM   64  H   UNK A   1       3.865  -2.423   1.215  1.00  0.00           H  
HETATM   65  H   UNK A   1       3.184   0.170  -0.229  1.00  0.00           H  
HETATM   66  H   UNK A   1       3.783   0.078   1.444  1.00  0.00           H  
HETATM   67  H   UNK A   1       5.823  -1.087   0.650  1.00  0.00           H  
HETATM   68  H   UNK A   1       5.224  -0.995  -1.024  1.00  0.00           H  
HETATM   69  H   UNK A   1       9.619   1.825  -0.549  1.00  0.00           H  
HETATM   70  H   UNK A   1       9.019   1.917  -2.222  1.00  0.00           H  
HETATM   71  H   UNK A   1       9.361   3.411  -1.316  1.00  0.00           H  
HETATM   72  H   UNK A   1       7.880   4.087   0.580  1.00  0.00           H  
HETATM   73  H   UNK A   1       6.485   3.075   1.024  1.00  0.00           H  
HETATM   74  H   UNK A   1       8.139   2.501   1.347  1.00  0.00           H  
HETATM   75  H   UNK A   1       7.039   4.216  -1.769  1.00  0.00           H  
HETATM   76  H   UNK A   1       6.698   2.723  -2.675  1.00  0.00           H  
HETATM   77  H   UNK A   1       5.644   3.204  -1.325  1.00  0.00           H  
HETATM   78  H   UNK A   2      -3.143  -0.994   2.004  1.00  0.00           H  
HETATM   79  H   UNK A   1       3.913  -2.556  -1.219  1.00  0.00           H  
CONECT    1    2   39   40   41                                       
CONECT    2    1    3    4   42                                       
CONECT    3    2   43   44   45                                       
CONECT    4    2    5   46   47                                       
CONECT    5    6    4   33   48                                       
CONECT    6   31   18   18    5                                       
CONECT    7    8   31   17   17                                       
CONECT    8    9    9    7   49                                       
CONECT    9   34    8    8   15                                       
CONECT   10   14   11   34   50                                       
CONECT   11   12   10   51   52                                       
CONECT   12   13   11   53   54                                       
CONECT   13   12   14   55   56                                       
CONECT   14   13   10   57   58                                       
CONECT   15    9   16   16   59                                       
CONECT   16   15   15   17   60                                       
CONECT   17    7    7   16   18                                       
CONECT   18   17    6    6   19                                       
CONECT   19   18   20   61   62                                       
CONECT   20   19   33   21   63                                       
CONECT   21   20   35   35   32                                       
CONECT   22   30   32   23   64                                       
CONECT   23   22   24   65   66                                       
CONECT   24   23   25   67   68                                       
CONECT   25   24   37   36   36                                       
CONECT   26   29   37   27   28                                       
CONECT   27   26   69   70   71                                       
CONECT   28   26   72   73   74                                       
CONECT   29   26   75   76   77                                       
CONECT   30   33   38   38   22                                       
CONECT   31    7    6   78                                            
CONECT   32   21   22   79                                            
CONECT   33    5   20   30                                            
CONECT   34   10    9                                                 
CONECT   35   21   21                                                 
CONECT   36   25   25                                                 
CONECT   37   25   26                                                 
CONECT   38   30   30                                                 
CONECT   39    1                                                      
CONECT   40    1                                                      
CONECT   41    1                                                      
CONECT   42    2                                                      
CONECT   43    3                                                      
CONECT   44    3                                                      
CONECT   45    3                                                      
CONECT   46    4                                                      
CONECT   47    4                                                      
CONECT   48    5                                                      
CONECT   49    8                                                      
CONECT   50   10                                                      
CONECT   51   11                                                      
CONECT   52   11                                                      
CONECT   53   12                                                      
CONECT   54   12                                                      
CONECT   55   13                                                      
CONECT   56   13                                                      
CONECT   57   14                                                      
CONECT   58   14                                                      
CONECT   59   15                                                      
CONECT   60   16                                                      
CONECT   61   19                                                      
CONECT   62   19                                                      
CONECT   63   20                                                      
CONECT   64   22                                                      
CONECT   65   23                                                      
CONECT   66   23                                                      
CONECT   67   24                                                      
CONECT   68   24                                                      
CONECT   69   27                                                      
CONECT   70   27                                                      
CONECT   71   27                                                      
CONECT   72   28                                                      
CONECT   73   28                                                      
CONECT   74   28                                                      
CONECT   75   29                                                      
CONECT   76   29                                                      
CONECT   77   29                                                      
CONECT   78   31                                                      
CONECT   79   32                                                      
MASTER        0    0    0    0    0    0    0    0   79    0   79    0
END
