COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       8.464   4.017  -0.808  1.00  0.00           C  
HETATM    2  C   UNL     1       7.462   3.615   0.276  1.00  0.00           C  
HETATM    3  C   UNL     1       6.215   3.019  -0.378  1.00  0.00           C  
HETATM    4  C   UNL     1       5.213   2.617   0.706  1.00  0.00           C  
HETATM    5  C   UNL     1       3.965   2.021   0.052  1.00  0.00           C  
HETATM    6  C   UNL     1       2.963   1.619   1.136  1.00  0.00           C  
HETATM    7  C   UNL     1       1.734   1.031   0.491  1.00  0.00           C  
HETATM    8  O   UNL     1      -8.477  -0.177  -1.436  1.00  0.00           O  
HETATM    9  C   UNL     1      -8.342  -0.554  -0.064  1.00  0.00           C  
HETATM   10  C   UNL     1      -9.724  -0.609   0.589  1.00  0.00           C  
HETATM   11  C   UNL     1      -7.681  -1.932   0.023  1.00  0.00           C  
HETATM   12  C   UNL     1      -7.474   0.474   0.664  1.00  0.00           C  
HETATM   13  C   UNL     1      -6.092   0.529   0.012  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.224   1.558   0.740  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.842   1.613   0.087  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.974   2.641   0.815  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.612   2.695   0.172  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.607   1.864   0.619  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.375   3.575  -0.869  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.128   3.632  -1.467  1.00  0.00           C  
HETATM   21  C   UNL     1       0.889   2.811  -1.028  1.00  0.00           C  
HETATM   22  C   UNL     1       0.656   1.915   0.021  1.00  0.00           C  
HETATM   23  C   UNL     1       1.622  -0.307   0.346  1.00  0.00           C  
HETATM   24  C   UNL     1       2.658  -1.156   0.798  1.00  0.00           C  
HETATM   25  C   UNL     1       2.546  -2.497   0.652  1.00  0.00           C  
HETATM   26  C   UNL     1       1.359  -3.111   0.026  1.00  0.00           C  
HETATM   27  C   UNL     1       0.123  -2.695   0.313  1.00  0.00           C  
HETATM   28  C   UNL     1       1.610  -4.234  -0.959  1.00  0.00           C  
HETATM   29  O   UNL     1       2.138  -3.700  -2.175  1.00  0.00           O  
HETATM   30  C   UNL     1       2.620  -5.204  -0.338  1.00  0.00           C  
HETATM   31  C   UNL     1       3.908  -4.457   0.010  1.00  0.00           C  
HETATM   32  O   UNL     1       4.895  -5.391   0.451  1.00  0.00           O  
HETATM   33  C   UNL     1       3.637  -3.441   1.118  1.00  0.00           C  
HETATM   34  H   UNL     1       9.353   4.442  -0.341  1.00  0.00           H  
HETATM   35  H   UNL     1       8.744   3.137  -1.388  1.00  0.00           H  
HETATM   36  H   UNL     1       8.010   4.757  -1.466  1.00  0.00           H  
HETATM   37  H   UNL     1       7.917   2.875   0.935  1.00  0.00           H  
HETATM   38  H   UNL     1       7.183   4.495   0.857  1.00  0.00           H  
HETATM   39  H   UNL     1       5.760   3.759  -1.036  1.00  0.00           H  
HETATM   40  H   UNL     1       6.494   2.139  -0.958  1.00  0.00           H  
HETATM   41  H   UNL     1       5.667   1.877   1.365  1.00  0.00           H  
HETATM   42  H   UNL     1       4.933   3.497   1.286  1.00  0.00           H  
HETATM   43  H   UNL     1       3.511   2.761  -0.607  1.00  0.00           H  
HETATM   44  H   UNL     1       4.244   1.141  -0.529  1.00  0.00           H  
HETATM   45  H   UNL     1       3.417   0.879   1.794  1.00  0.00           H  
HETATM   46  H   UNL     1       2.683   2.499   1.716  1.00  0.00           H  
HETATM   47  H   UNL     1      -8.889   0.688  -1.567  1.00  0.00           H  
HETATM   48  H   UNL     1     -10.342  -1.342   0.070  1.00  0.00           H  
HETATM   49  H   UNL     1      -9.621  -0.897   1.635  1.00  0.00           H  
HETATM   50  H   UNL     1     -10.195   0.372   0.527  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.696  -1.893  -0.442  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.578  -2.219   1.069  1.00  0.00           H  
HETATM   53  H   UNL     1      -8.299  -2.664  -0.496  1.00  0.00           H  
HETATM   54  H   UNL     1      -7.945   1.456   0.602  1.00  0.00           H  
HETATM   55  H   UNL     1      -7.371   0.186   1.711  1.00  0.00           H  
HETATM   56  H   UNL     1      -5.621  -0.452   0.074  1.00  0.00           H  
HETATM   57  H   UNL     1      -6.195   0.817  -1.035  1.00  0.00           H  
HETATM   58  H   UNL     1      -5.695   2.539   0.678  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.121   1.270   1.786  1.00  0.00           H  
HETATM   60  H   UNL     1      -3.371   0.631   0.149  1.00  0.00           H  
HETATM   61  H   UNL     1      -3.945   1.900  -0.959  1.00  0.00           H  
HETATM   62  H   UNL     1      -3.444   3.622   0.753  1.00  0.00           H  
HETATM   63  H   UNL     1      -2.871   2.353   1.862  1.00  0.00           H  
HETATM   64  H   UNL     1      -0.795   1.175   1.430  1.00  0.00           H  
HETATM   65  H   UNL     1      -2.168   4.221  -1.218  1.00  0.00           H  
HETATM   66  H   UNL     1       0.049   4.322  -2.279  1.00  0.00           H  
HETATM   67  H   UNL     1       1.861   2.857  -1.495  1.00  0.00           H  
HETATM   68  H   UNL     1       0.741  -0.728  -0.116  1.00  0.00           H  
HETATM   69  H   UNL     1       3.539  -0.735   1.260  1.00  0.00           H  
HETATM   70  H   UNL     1      -0.025  -1.892   1.019  1.00  0.00           H  
HETATM   71  H   UNL     1      -0.727  -3.163  -0.160  1.00  0.00           H  
HETATM   72  H   UNL     1       0.676  -4.759  -1.164  1.00  0.00           H  
HETATM   73  H   UNL     1       1.554  -3.065  -2.612  1.00  0.00           H  
HETATM   74  H   UNL     1       2.196  -5.636   0.568  1.00  0.00           H  
HETATM   75  H   UNL     1       2.844  -6.001  -1.048  1.00  0.00           H  
HETATM   76  H   UNL     1       4.274  -3.934  -0.874  1.00  0.00           H  
HETATM   77  H   UNL     1       5.741  -4.987   0.690  1.00  0.00           H  
HETATM   78  H   UNL     1       4.545  -2.877   1.328  1.00  0.00           H  
HETATM   79  H   UNL     1       3.311  -3.962   2.018  1.00  0.00           H  
CONECT    1    2   34   35   36                                       
CONECT    2    1    3   37   38                                       
CONECT    3    2    4   39   40                                       
CONECT    4    3    5   41   42                                       
CONECT    5    4    6   43   44                                       
CONECT    6    5    7   45   46                                       
CONECT    7   23   23    6   22                                       
CONECT    8    9   47                                                 
CONECT    9   11   10    8   12                                       
CONECT   10    9   48   49   50                                       
CONECT   11    9   51   52   53                                       
CONECT   12    9   13   54   55                                       
CONECT   13   12   14   56   57                                       
CONECT   14   13   15   58   59                                       
CONECT   15   14   16   60   61                                       
CONECT   16   15   17   62   63                                       
CONECT   17   16   18   18   19                                       
CONECT   18   17   17   22   64                                       
CONECT   19   17   20   20   65                                       
CONECT   20   19   19   21   66                                       
CONECT   21   22   22   20   67                                       
CONECT   22   18    7   21   21                                       
CONECT   23   24    7    7   68                                       
CONECT   24   25   25   23   69                                       
CONECT   25   26   33   24   24                                       
CONECT   26   27   27   25   28                                       
CONECT   27   26   26   70   71                                       
CONECT   28   26   30   29   72                                       
CONECT   29   28   73                                                 
CONECT   30   31   28   74   75                                       
CONECT   31   33   30   32   76                                       
CONECT   32   31   77                                                 
CONECT   33   25   31   78   79                                       
CONECT   34    1                                                      
CONECT   35    1                                                      
CONECT   36    1                                                      
CONECT   37    2                                                      
CONECT   38    2                                                      
CONECT   39    3                                                      
CONECT   40    3                                                      
CONECT   41    4                                                      
CONECT   42    4                                                      
CONECT   43    5                                                      
CONECT   44    5                                                      
CONECT   45    6                                                      
CONECT   46    6                                                      
CONECT   47    8                                                      
CONECT   48   10                                                      
CONECT   49   10                                                      
CONECT   50   10                                                      
CONECT   51   11                                                      
CONECT   52   11                                                      
CONECT   53   11                                                      
CONECT   54   12                                                      
CONECT   55   12                                                      
CONECT   56   13                                                      
CONECT   57   13                                                      
CONECT   58   14                                                      
CONECT   59   14                                                      
CONECT   60   15                                                      
CONECT   61   15                                                      
CONECT   62   16                                                      
CONECT   63   16                                                      
CONECT   64   18                                                      
CONECT   65   19                                                      
CONECT   66   20                                                      
CONECT   67   21                                                      
CONECT   68   23                                                      
CONECT   69   24                                                      
CONECT   70   27                                                      
CONECT   71   27                                                      
CONECT   72   28                                                      
CONECT   73   29                                                      
CONECT   74   30                                                      
CONECT   75   30                                                      
CONECT   76   31                                                      
CONECT   77   32                                                      
CONECT   78   33                                                      
CONECT   79   33                                                      
MASTER        0    0    0    0    0    0    0    0   79    0   79    0
END
