COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       8.920   3.404  -0.555  1.00  0.00           C  
HETATM    2  C   UNL     1       8.466   4.362   0.299  1.00  0.00           C  
HETATM    3  C   UNL     1       7.271   4.193   0.998  1.00  0.00           C  
HETATM    4  C   UNL     1       6.524   3.066   0.847  1.00  0.00           C  
HETATM    5  C   UNL     1       6.961   2.053  -0.027  1.00  0.00           C  
HETATM    6  C   UNL     1       8.175   2.228  -0.743  1.00  0.00           C  
HETATM    7  C   UNL     1       6.684   0.002  -1.023  1.00  0.00           C  
HETATM    8  C   UNL     1       7.883   0.181  -1.735  1.00  0.00           C  
HETATM    9  C   UNL     1       5.895  -1.238  -1.211  1.00  0.00           C  
HETATM   10  C   UNL     1       3.959  -2.636  -0.725  1.00  0.00           C  
HETATM   11  C   UNL     1       2.721  -2.578   0.132  1.00  0.00           C  
HETATM   12  C   UNL     1       1.488  -2.171  -0.251  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.671  -1.977   0.914  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.548  -2.485  -0.035  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.150  -1.165   1.933  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.496  -0.859   1.996  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.365  -1.361   1.045  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.892  -2.175   0.033  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.033  -3.372  -1.139  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.341  -2.958  -2.580  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.063  -4.154  -1.956  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.203  -0.617   2.970  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.390  -1.086   4.414  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.778   0.340   4.016  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.833  -1.026   1.116  1.00  0.00           C  
HETATM   26  C   UNL     1      -5.099   0.233   0.331  1.00  0.00           C  
HETATM   27  C   UNL     1      -6.610   1.949  -0.511  1.00  0.00           C  
HETATM   28  C   UNL     1      -8.915   1.138  -1.029  1.00  0.00           C  
HETATM   29  C   UNL     1      -8.099   2.290  -0.439  1.00  0.00           C  
HETATM   30  C   UNL     1      -6.206   1.734  -1.971  1.00  0.00           C  
HETATM   31  C   UNL     1      -7.022   0.582  -2.561  1.00  0.00           C  
HETATM   32  C   UNL     1      -8.512   0.923  -2.489  1.00  0.00           C  
HETATM   33  C   UNL     1      -5.806   3.084   0.070  1.00  0.00           C  
HETATM   34  N   UNL     1       8.598   1.270  -1.577  1.00  0.00           N  
HETATM   35  N   UNL     1       6.250   0.937  -0.196  1.00  0.00           N  
HETATM   36  N   UNL     1       4.739  -1.410  -0.540  1.00  0.00           N  
HETATM   37  N   UNL     1       1.414  -2.742   1.815  1.00  0.00           N  
HETATM   38  N   UNL     1       2.624  -2.926   1.421  1.00  0.00           N  
HETATM   39  N   UNL     1       0.694  -2.289   0.848  1.00  0.00           N  
HETATM   40  N   UNL     1      -6.351   0.726   0.253  1.00  0.00           N  
HETATM   41  O   UNL     1       6.290  -2.100  -1.971  1.00  0.00           O  
HETATM   42  O   UNL     1      -4.187   0.801  -0.232  1.00  0.00           O  
HETATM   43  O   UNL     1      -4.585   2.851   0.576  1.00  0.00           O  
HETATM   44  O   UNL     1      -6.261   4.203   0.080  1.00  0.00           O  
HETATM   45  H   UNL     1       9.847   3.550  -1.089  1.00  0.00           H  
HETATM   46  H   UNL     1       9.040   5.266   0.438  1.00  0.00           H  
HETATM   47  H   UNL     1       6.933   4.969   1.669  1.00  0.00           H  
HETATM   48  H   UNL     1       5.602   2.949   1.395  1.00  0.00           H  
HETATM   49  H   UNL     1       8.226  -0.591  -2.408  1.00  0.00           H  
HETATM   50  H   UNL     1       4.561  -3.497  -0.437  1.00  0.00           H  
HETATM   51  H   UNL     1       3.671  -2.728  -1.773  1.00  0.00           H  
HETATM   52  H   UNL     1       1.195  -1.822  -1.230  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.869  -0.227   2.788  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.574  -2.566  -0.709  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.073  -3.851  -0.948  1.00  0.00           H  
HETATM   56  H   UNL     1      -1.917  -2.045  -2.729  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.584  -3.166  -3.336  1.00  0.00           H  
HETATM   58  H   UNL     1      -1.781  -5.149  -2.302  1.00  0.00           H  
HETATM   59  H   UNL     1      -3.114  -4.027  -1.694  1.00  0.00           H  
HETATM   60  H   UNL     1       0.815  -0.436   2.627  1.00  0.00           H  
HETATM   61  H   UNL     1      -1.197  -1.790   4.615  1.00  0.00           H  
HETATM   62  H   UNL     1       0.507  -1.213   5.022  1.00  0.00           H  
HETATM   63  H   UNL     1      -0.137   1.151   4.361  1.00  0.00           H  
HETATM   64  H   UNL     1      -1.840   0.574   3.954  1.00  0.00           H  
HETATM   65  H   UNL     1      -5.414  -1.846   0.696  1.00  0.00           H  
HETATM   66  H   UNL     1      -5.121  -0.872   2.156  1.00  0.00           H  
HETATM   67  H   UNL     1      -8.723   0.228  -0.460  1.00  0.00           H  
HETATM   68  H   UNL     1      -9.977   1.381  -0.977  1.00  0.00           H  
HETATM   69  H   UNL     1      -8.387   2.444   0.601  1.00  0.00           H  
HETATM   70  H   UNL     1      -8.292   3.200  -1.007  1.00  0.00           H  
HETATM   71  H   UNL     1      -6.399   2.644  -2.539  1.00  0.00           H  
HETATM   72  H   UNL     1      -5.145   1.491  -2.023  1.00  0.00           H  
HETATM   73  H   UNL     1      -6.734   0.428  -3.601  1.00  0.00           H  
HETATM   74  H   UNL     1      -6.829  -0.328  -1.993  1.00  0.00           H  
HETATM   75  H   UNL     1      -9.093   0.102  -2.909  1.00  0.00           H  
HETATM   76  H   UNL     1      -8.704   1.832  -3.057  1.00  0.00           H  
HETATM   77  H   UNL     1       4.424  -0.721   0.067  1.00  0.00           H  
HETATM   78  H   UNL     1      -7.080   0.272   0.703  1.00  0.00           H  
HETATM   79  H   UNL     1      -4.108   3.611   0.938  1.00  0.00           H  
CONECT    1    6    6    2   45                                       
CONECT    2    1    3    3   46                                       
CONECT    3    2    2    4   47                                       
CONECT    4    5    5    3   48                                       
CONECT    5    6   35    4    4                                       
CONECT    6   34    1    1    5                                       
CONECT    7    8    9   35   35                                       
CONECT    8   34   34    7   49                                       
CONECT    9   41   41    7   36                                       
CONECT   10   11   36   50   51                                       
CONECT   11   12   12   10   38                                       
CONECT   12   39   11   11   52                                       
CONECT   13   15   39   14   14                                       
CONECT   14   13   13   18   19                                       
CONECT   15   22   16   16   13                                       
CONECT   16   15   15   17   53                                       
CONECT   17   16   25   18   18                                       
CONECT   18   17   17   14   54                                       
CONECT   19   14   20   21   55                                       
CONECT   20   19   21   56   57                                       
CONECT   21   19   20   58   59                                       
CONECT   22   24   23   15   60                                       
CONECT   23   24   22   61   62                                       
CONECT   24   23   22   63   64                                       
CONECT   25   26   17   65   66                                       
CONECT   26   40   42   42   25                                       
CONECT   27   30   33   29   40                                       
CONECT   28   32   29   67   68                                       
CONECT   29   27   28   69   70                                       
CONECT   30   31   27   71   72                                       
CONECT   31   30   32   73   74                                       
CONECT   32   31   28   75   76                                       
CONECT   33   44   44   43   27                                       
CONECT   34    8    8    6                                            
CONECT   35    7    7    5                                            
CONECT   36    9   10   77                                            
CONECT   37   39   38   38                                            
CONECT   38   11   37   37                                            
CONECT   39   13   12   37                                            
CONECT   40   27   26   78                                            
CONECT   41    9    9                                                 
CONECT   42   26   26                                                 
CONECT   43   33   79                                                 
CONECT   44   33   33                                                 
CONECT   45    1                                                      
CONECT   46    2                                                      
CONECT   47    3                                                      
CONECT   48    4                                                      
CONECT   49    8                                                      
CONECT   50   10                                                      
CONECT   51   10                                                      
CONECT   52   12                                                      
CONECT   53   16                                                      
CONECT   54   18                                                      
CONECT   55   19                                                      
CONECT   56   20                                                      
CONECT   57   20                                                      
CONECT   58   21                                                      
CONECT   59   21                                                      
CONECT   60   22                                                      
CONECT   61   23                                                      
CONECT   62   23                                                      
CONECT   63   24                                                      
CONECT   64   24                                                      
CONECT   65   25                                                      
CONECT   66   25                                                      
CONECT   67   28                                                      
CONECT   68   28                                                      
CONECT   69   29                                                      
CONECT   70   29                                                      
CONECT   71   30                                                      
CONECT   72   30                                                      
CONECT   73   31                                                      
CONECT   74   31                                                      
CONECT   75   32                                                      
CONECT   76   32                                                      
CONECT   77   36                                                      
CONECT   78   40                                                      
CONECT   79   43                                                      
MASTER        0    0    0    0    0    0    0    0   79    0   79    0
END
