COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.469  -0.651  -0.277  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.496   0.254  -0.458  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.773  -0.048  -0.007  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.015  -1.260   0.623  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.984  -2.162   0.802  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.712  -1.858   0.352  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.590  -2.844   0.548  1.00  0.00           C  
HETATM    8  C   UNL     1       0.725  -2.178   0.234  1.00  0.00           C  
HETATM    9  C   UNL     1       1.056  -0.983   0.846  1.00  0.00           C  
HETATM   10  C   UNL     1       1.601  -2.765  -0.660  1.00  0.00           C  
HETATM   11  C   UNL     1       2.806  -2.156  -0.949  1.00  0.00           C  
HETATM   12  C   UNL     1       3.139  -0.954  -0.340  1.00  0.00           C  
HETATM   13  C   UNL     1       2.261  -0.370   0.560  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.583  -3.328   1.999  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.527  -2.121   2.939  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.791  -4.039  -0.387  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.964  -3.540  -1.823  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.400  -1.591   1.115  1.00  0.00           C  
HETATM   19  C   UNL     1       3.761  -2.797  -1.924  1.00  0.00           C  
HETATM   20  O   UNL     1       4.325  -0.353  -0.623  1.00  0.00           O  
HETATM   21  O   UNL     1      -4.785   0.841  -0.184  1.00  0.00           O  
HETATM   22  C   UNL     1       4.600   0.882   0.041  1.00  0.00           C  
HETATM   23  C   UNL     1       5.969   1.403  -0.400  1.00  0.00           C  
HETATM   24  C   UNL     1       6.210   2.784   0.213  1.00  0.00           C  
HETATM   25  O   UNL     1       6.987   0.502   0.042  1.00  0.00           O  
HETATM   26  C   UNL     1       6.172   2.679   1.739  1.00  0.00           C  
HETATM   27  C   UNL     1       7.580   3.306  -0.228  1.00  0.00           C  
HETATM   28  C   UNL     1       5.121   3.749  -0.260  1.00  0.00           C  
HETATM   29  C   UNL     1      -4.442   2.115  -0.734  1.00  0.00           C  
HETATM   30  C   UNL     1      -5.492   3.148  -0.322  1.00  0.00           C  
HETATM   31  C   UNL     1      -4.394   2.015  -2.260  1.00  0.00           C  
HETATM   32  C   UNL     1      -5.453   3.339   1.196  1.00  0.00           C  
HETATM   33  O   UNL     1      -5.702   1.728  -2.759  1.00  0.00           O  
HETATM   34  O   UNL     1      -6.435   4.304   1.580  1.00  0.00           O  
HETATM   35  H   UNL     1      -0.476  -0.418  -0.632  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.305   1.197  -0.949  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.171  -3.105   1.293  1.00  0.00           H  
HETATM   38  H   UNL     1       0.372  -0.528   1.547  1.00  0.00           H  
HETATM   39  H   UNL     1       1.342  -3.701  -1.133  1.00  0.00           H  
HETATM   40  H   UNL     1       2.518   0.564   1.038  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.490  -3.900   2.196  1.00  0.00           H  
HETATM   42  H   UNL     1       0.289  -3.960   2.168  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.757  -2.441   3.955  1.00  0.00           H  
HETATM   44  H   UNL     1       0.471  -1.686   2.912  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.257  -1.378   2.618  1.00  0.00           H  
HETATM   46  H   UNL     1       0.078  -4.694  -0.332  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.681  -4.591  -0.084  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.142  -4.388  -2.483  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.813  -2.858  -1.870  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.060  -3.018  -2.137  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.953  -2.100   0.325  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.331  -2.241   1.987  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.919  -0.672   1.387  1.00  0.00           H  
HETATM   54  H   UNL     1       3.547  -2.438  -2.931  1.00  0.00           H  
HETATM   55  H   UNL     1       4.784  -2.536  -1.655  1.00  0.00           H  
HETATM   56  H   UNL     1       3.641  -3.880  -1.891  1.00  0.00           H  
HETATM   57  H   UNL     1       3.833   1.612  -0.218  1.00  0.00           H  
HETATM   58  H   UNL     1       4.601   0.723   1.119  1.00  0.00           H  
HETATM   59  H   UNL     1       5.997   1.478  -1.487  1.00  0.00           H  
HETATM   60  H   UNL     1       7.020   0.387   1.001  1.00  0.00           H  
HETATM   61  H   UNL     1       6.947   1.992   2.076  1.00  0.00           H  
HETATM   62  H   UNL     1       6.343   3.663   2.175  1.00  0.00           H  
HETATM   63  H   UNL     1       5.196   2.308   2.053  1.00  0.00           H  
HETATM   64  H   UNL     1       7.608   3.380  -1.315  1.00  0.00           H  
HETATM   65  H   UNL     1       7.752   4.290   0.209  1.00  0.00           H  
HETATM   66  H   UNL     1       8.356   2.618   0.109  1.00  0.00           H  
HETATM   67  H   UNL     1       4.146   3.378   0.054  1.00  0.00           H  
HETATM   68  H   UNL     1       5.293   4.733   0.176  1.00  0.00           H  
HETATM   69  H   UNL     1       5.149   3.824  -1.347  1.00  0.00           H  
HETATM   70  H   UNL     1      -3.465   2.421  -0.359  1.00  0.00           H  
HETATM   71  H   UNL     1      -5.280   4.098  -0.813  1.00  0.00           H  
HETATM   72  H   UNL     1      -6.481   2.799  -0.619  1.00  0.00           H  
HETATM   73  H   UNL     1      -4.047   2.961  -2.675  1.00  0.00           H  
HETATM   74  H   UNL     1      -3.711   1.217  -2.551  1.00  0.00           H  
HETATM   75  H   UNL     1      -5.666   2.389   1.686  1.00  0.00           H  
HETATM   76  H   UNL     1      -4.464   3.688   1.492  1.00  0.00           H  
HETATM   77  H   UNL     1      -5.747   1.651  -3.722  1.00  0.00           H  
HETATM   78  H   UNL     1      -6.466   4.475   2.531  1.00  0.00           H  
CONECT    1    2    2    6   35                                       
CONECT    2    1    1    3   36                                       
CONECT    3    2    4    4   21                                       
CONECT    4    3    3    5   18                                       
CONECT    5    4    6    6   37                                       
CONECT    6    1    5    5    7                                       
CONECT    7    6    8   14   16                                       
CONECT    8    7    9    9   10                                       
CONECT    9    8    8   13   38                                       
CONECT   10    8   11   11   39                                       
CONECT   11   10   10   12   19                                       
CONECT   12   11   13   13   20                                       
CONECT   13    9   12   12   40                                       
CONECT   14    7   15   41   42                                       
CONECT   15   14   43   44   45                                       
CONECT   16    7   17   46   47                                       
CONECT   17   16   48   49   50                                       
CONECT   18    4   51   52   53                                       
CONECT   19   11   54   55   56                                       
CONECT   20   12   22                                                 
CONECT   21    3   29                                                 
CONECT   22   20   23   57   58                                       
CONECT   23   22   24   25   59                                       
CONECT   24   23   26   27   28                                       
CONECT   25   23   60                                                 
CONECT   26   24   61   62   63                                       
CONECT   27   24   64   65   66                                       
CONECT   28   24   67   68   69                                       
CONECT   29   21   30   31   70                                       
CONECT   30   29   32   71   72                                       
CONECT   31   29   33   73   74                                       
CONECT   32   30   34   75   76                                       
CONECT   33   31   77                                                 
CONECT   34   32   78                                                 
CONECT   35    1                                                      
CONECT   36    2                                                      
CONECT   37    5                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   13                                                      
CONECT   41   14                                                      
CONECT   42   14                                                      
CONECT   43   15                                                      
CONECT   44   15                                                      
CONECT   45   15                                                      
CONECT   46   16                                                      
CONECT   47   16                                                      
CONECT   48   17                                                      
CONECT   49   17                                                      
CONECT   50   17                                                      
CONECT   51   18                                                      
CONECT   52   18                                                      
CONECT   53   18                                                      
CONECT   54   19                                                      
CONECT   55   19                                                      
CONECT   56   19                                                      
CONECT   57   22                                                      
CONECT   58   22                                                      
CONECT   59   23                                                      
CONECT   60   25                                                      
CONECT   61   26                                                      
CONECT   62   26                                                      
CONECT   63   26                                                      
CONECT   64   27                                                      
CONECT   65   27                                                      
CONECT   66   27                                                      
CONECT   67   28                                                      
CONECT   68   28                                                      
CONECT   69   28                                                      
CONECT   70   29                                                      
CONECT   71   30                                                      
CONECT   72   30                                                      
CONECT   73   31                                                      
CONECT   74   31                                                      
CONECT   75   32                                                      
CONECT   76   32                                                      
CONECT   77   33                                                      
CONECT   78   34                                                      
MASTER        0    0    0    0    0    0    0    0   78    0   78    0
END
