COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.455   2.519   0.482  1.00  0.00           C  
HETATM    2  C   UNL     1       2.582   4.664   1.024  1.00  0.00           C  
HETATM    3  C   UNL     1       6.766  -1.718  -0.635  1.00  0.00           C  
HETATM    4  C   UNL     1       5.994  -1.771   0.527  1.00  0.00           C  
HETATM    5  C   UNL     1       6.082  -0.679   1.561  1.00  0.00           C  
HETATM    6  C   UNL     1       5.158   0.449   1.180  1.00  0.00           C  
HETATM    7  C   UNL     1       5.620   1.481   0.385  1.00  0.00           C  
HETATM    8  C   UNL     1       4.772   2.519   0.034  1.00  0.00           C  
HETATM    9  C   UNL     1       6.589   3.468  -1.173  1.00  0.00           C  
HETATM   10  C   UNL     1       2.997   1.481   1.279  1.00  0.00           C  
HETATM   11  C   UNL     1       1.572   1.478   1.767  1.00  0.00           C  
HETATM   12  C   UNL     1       0.668   0.860   0.697  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.757   0.856   1.185  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.714  -1.601  -0.854  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.134   0.339   0.853  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.732  -1.010   0.537  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.065  -1.912  -0.267  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.644  -3.141  -0.549  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.881  -3.468  -0.023  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.549  -2.559   0.793  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.969  -1.333   1.069  1.00  0.00           C  
HETATM   22  C   UNL     1       3.849   0.449   1.626  1.00  0.00           C  
HETATM   23  C   UNL     1       5.148  -2.848   0.707  1.00  0.00           C  
HETATM   24  C   UNL     1       5.838  -3.716  -1.314  1.00  0.00           C  
HETATM   25  C   UNL     1      -7.388  -1.892   2.144  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.701  -5.556  -1.148  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.907   1.415   0.135  1.00  0.00           C  
HETATM   28  C   UNL     1      -4.475   2.452   0.851  1.00  0.00           C  
HETATM   29  C   UNL     1      -4.043   1.366  -1.240  1.00  0.00           C  
HETATM   30  C   UNL     1      -5.184   3.440   0.196  1.00  0.00           C  
HETATM   31  C   UNL     1      -6.129   4.245  -3.252  1.00  0.00           C  
HETATM   32  C   UNL     1      -4.751   2.351  -1.901  1.00  0.00           C  
HETATM   33  C   UNL     1      -5.326   3.390  -1.184  1.00  0.00           C  
HETATM   34  N   UNL     1       7.633  -0.660  -0.856  1.00  0.00           N  
HETATM   35  N   UNL     1      -1.735   0.356   0.404  1.00  0.00           N  
HETATM   36  N   UNL     1      -1.461  -0.156  -0.839  1.00  0.00           N  
HETATM   37  N   UNL     1       5.094  -3.792  -0.220  1.00  0.00           N  
HETATM   38  N   UNL     1       5.752  -4.723  -2.260  1.00  0.00           N  
HETATM   39  N   UNL     1       6.661  -2.701  -1.525  1.00  0.00           N  
HETATM   40  O   UNL     1       5.225   3.534  -0.749  1.00  0.00           O  
HETATM   41  O   UNL     1       2.620   3.538   0.145  1.00  0.00           O  
HETATM   42  O   UNL     1      -1.025   1.304   2.280  1.00  0.00           O  
HETATM   43  O   UNL     1      -6.764  -2.875   1.316  1.00  0.00           O  
HETATM   44  O   UNL     1      -5.444  -4.674  -0.303  1.00  0.00           O  
HETATM   45  O   UNL     1      -6.023   4.360  -1.831  1.00  0.00           O  
HETATM   46  H   UNL     1       2.263   4.340   2.015  1.00  0.00           H  
HETATM   47  H   UNL     1       3.575   5.108   1.089  1.00  0.00           H  
HETATM   48  H   UNL     1       1.878   5.402   0.639  1.00  0.00           H  
HETATM   49  H   UNL     1       5.790  -1.075   2.534  1.00  0.00           H  
HETATM   50  H   UNL     1       7.106  -0.308   1.612  1.00  0.00           H  
HETATM   51  H   UNL     1       6.643   1.479   0.038  1.00  0.00           H  
HETATM   52  H   UNL     1       7.240   3.458  -0.299  1.00  0.00           H  
HETATM   53  H   UNL     1       6.745   2.559  -1.753  1.00  0.00           H  
HETATM   54  H   UNL     1       6.820   4.337  -1.788  1.00  0.00           H  
HETATM   55  H   UNL     1       1.503   0.892   2.683  1.00  0.00           H  
HETATM   56  H   UNL     1       1.253   2.501   1.964  1.00  0.00           H  
HETATM   57  H   UNL     1       0.738   1.445  -0.219  1.00  0.00           H  
HETATM   58  H   UNL     1       0.987  -0.164   0.500  1.00  0.00           H  
HETATM   59  H   UNL     1      -0.944  -2.107  -0.271  1.00  0.00           H  
HETATM   60  H   UNL     1      -1.678  -1.960  -1.883  1.00  0.00           H  
HETATM   61  H   UNL     1      -3.174   0.514   1.928  1.00  0.00           H  
HETATM   62  H   UNL     1      -3.126  -3.846  -1.182  1.00  0.00           H  
HETATM   63  H   UNL     1      -5.484  -0.625   1.701  1.00  0.00           H  
HETATM   64  H   UNL     1       3.491  -0.359   2.247  1.00  0.00           H  
HETATM   65  H   UNL     1       4.538  -2.920   1.596  1.00  0.00           H  
HETATM   66  H   UNL     1      -8.349  -2.269   2.494  1.00  0.00           H  
HETATM   67  H   UNL     1      -6.748  -1.678   2.999  1.00  0.00           H  
HETATM   68  H   UNL     1      -7.545  -0.979   1.569  1.00  0.00           H  
HETATM   69  H   UNL     1      -3.741  -5.781  -0.684  1.00  0.00           H  
HETATM   70  H   UNL     1      -5.262  -6.479  -1.291  1.00  0.00           H  
HETATM   71  H   UNL     1      -4.535  -5.078  -2.114  1.00  0.00           H  
HETATM   72  H   UNL     1      -4.364   2.490   1.925  1.00  0.00           H  
HETATM   73  H   UNL     1      -3.595   0.558  -1.798  1.00  0.00           H  
HETATM   74  H   UNL     1      -5.628   4.249   0.756  1.00  0.00           H  
HETATM   75  H   UNL     1      -6.626   3.309  -3.504  1.00  0.00           H  
HETATM   76  H   UNL     1      -6.708   5.082  -3.642  1.00  0.00           H  
HETATM   77  H   UNL     1      -5.132   4.257  -3.692  1.00  0.00           H  
HETATM   78  H   UNL     1      -4.857   2.313  -2.975  1.00  0.00           H  
HETATM   79  H   UNL     1       8.168  -0.632  -1.664  1.00  0.00           H  
HETATM   80  H   UNL     1       7.703   0.053  -0.202  1.00  0.00           H  
HETATM   81  H   UNL     1      -2.000   0.313  -1.551  1.00  0.00           H  
HETATM   82  H   UNL     1       6.291  -4.679  -3.066  1.00  0.00           H  
HETATM   83  H   UNL     1       5.152  -5.472  -2.118  1.00  0.00           H  
CONECT    1   41    8    8   10                                       
CONECT    2   41   46   47   48                                       
CONECT    3    4    4   39   34                                       
CONECT    4   23    5    3    3                                       
CONECT    5    6    4   49   50                                       
CONECT    6    7    7   22    5                                       
CONECT    7    8    6    6   51                                       
CONECT    8   40    1    1    7                                       
CONECT    9   40   52   53   54                                       
CONECT   10    1   11   22   22                                       
CONECT   11   10   12   55   56                                       
CONECT   12   11   13   57   58                                       
CONECT   13   42   42   12   35                                       
CONECT   14   36   17   59   60                                       
CONECT   15   27   35   16   61                                       
CONECT   16   15   21   21   17                                       
CONECT   17   16   14   18   18                                       
CONECT   18   17   17   19   62                                       
CONECT   19   20   20   18   44                                       
CONECT   20   21   43   19   19                                       
CONECT   21   16   16   20   63                                       
CONECT   22   10   10    6   64                                       
CONECT   23   37   37    4   65                                       
CONECT   24   37   38   39   39                                       
CONECT   25   43   66   67   68                                       
CONECT   26   44   69   70   71                                       
CONECT   27   28   15   29   29                                       
CONECT   28   30   30   27   72                                       
CONECT   29   27   27   32   73                                       
CONECT   30   28   28   33   74                                       
CONECT   31   45   75   76   77                                       
CONECT   32   33   33   29   78                                       
CONECT   33   30   45   32   32                                       
CONECT   34    3   79   80                                            
CONECT   35   13   15   36                                            
CONECT   36   35   14   81                                            
CONECT   37   23   23   24                                            
CONECT   38   24   82   83                                            
CONECT   39   24   24    3                                            
CONECT   40    9    8                                                 
CONECT   41    2    1                                                 
CONECT   42   13   13                                                 
CONECT   43   25   20                                                 
CONECT   44   19   26                                                 
CONECT   45   31   33                                                 
CONECT   46    2                                                      
CONECT   47    2                                                      
CONECT   48    2                                                      
CONECT   49    5                                                      
CONECT   50    5                                                      
CONECT   51    7                                                      
CONECT   52    9                                                      
CONECT   53    9                                                      
CONECT   54    9                                                      
CONECT   55   11                                                      
CONECT   56   11                                                      
CONECT   57   12                                                      
CONECT   58   12                                                      
CONECT   59   14                                                      
CONECT   60   14                                                      
CONECT   61   15                                                      
CONECT   62   18                                                      
CONECT   63   21                                                      
CONECT   64   22                                                      
CONECT   65   23                                                      
CONECT   66   25                                                      
CONECT   67   25                                                      
CONECT   68   25                                                      
CONECT   69   26                                                      
CONECT   70   26                                                      
CONECT   71   26                                                      
CONECT   72   28                                                      
CONECT   73   29                                                      
CONECT   74   30                                                      
CONECT   75   31                                                      
CONECT   76   31                                                      
CONECT   77   31                                                      
CONECT   78   32                                                      
CONECT   79   34                                                      
CONECT   80   34                                                      
CONECT   81   36                                                      
CONECT   82   38                                                      
CONECT   83   38                                                      
MASTER        0    0    0    0    0    0    0    0   83    0   83    0
END
