COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -3.349   1.174   0.012  1.00  0.00           N  
HETATM    2  C   UNL     1      -3.421   2.554   0.500  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.751   3.471  -0.490  1.00  0.00           C  
HETATM    4  O   UNL     1      -2.261   3.017  -1.503  1.00  0.00           O  
HETATM    5  C   UNL     1      -8.206  -5.044   1.234  1.00  0.00           C  
HETATM    6  C   UNL     1       9.688   0.163  -1.914  1.00  0.00           C  
HETATM    7  C   UNL     1       8.619   0.989  -1.595  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.512  -1.820   0.253  1.00  0.00           C  
HETATM    9  C   UNL     1       9.846  -1.054  -1.287  1.00  0.00           C  
HETATM   10  C   UNL     1       7.704   0.609  -0.654  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.712  -1.964  -0.382  1.00  0.00           C  
HETATM   12  C   UNL     1       7.709  -2.482   1.263  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.056   0.455   0.840  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.331   0.539  -0.702  1.00  0.00           C  
HETATM   15  C   UNL     1       4.607  -1.189   0.831  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.055   6.590  -0.428  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.231   6.265   1.638  1.00  0.00           C  
HETATM   18  C   UNL     1       5.819  -0.832   1.694  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.046   5.712  -1.202  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.282   5.370   0.971  1.00  0.00           C  
HETATM   21  C   UNL     1      -6.982  -2.967   1.006  1.00  0.00           C  
HETATM   22  C   UNL     1      -6.551  -4.799  -0.517  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.397  -1.984  -0.011  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.966  -3.815  -1.534  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.742  -1.738  -1.762  1.00  0.00           C  
HETATM   26  C   UNL     1       2.187  -0.916   0.901  1.00  0.00           C  
HETATM   27  C   UNL     1      -0.173  -0.610   0.857  1.00  0.00           C  
HETATM   28  C   UNL     1       7.076  -1.323   1.022  1.00  0.00           C  
HETATM   29  C   UNL     1      -3.948  -0.714  -0.991  1.00  0.00           C  
HETATM   30  C   UNL     1       8.930  -1.458  -0.322  1.00  0.00           C  
HETATM   31  C   UNL     1       7.846  -0.620  -0.006  1.00  0.00           C  
HETATM   32  C   UNL     1      -2.613  -0.898  -0.415  1.00  0.00           C  
HETATM   33  C   UNL     1      -2.283   0.323   0.199  1.00  0.00           C  
HETATM   34  N   UNL     1       3.385  -0.712   1.483  1.00  0.00           N  
HETATM   35  N   UNL     1       1.063  -0.478   1.502  1.00  0.00           N  
HETATM   36  N   UNL     1       8.814  -2.584   0.462  1.00  0.00           N  
HETATM   37  N   UNL     1      -7.566  -4.113   0.295  1.00  0.00           N  
HETATM   38  N   UNL     1      -5.382  -2.669  -0.823  1.00  0.00           N  
HETATM   39  N   UNL     1      -2.695   4.796  -0.250  1.00  0.00           N  
HETATM   40  O   UNL     1      -1.728   7.196   0.678  1.00  0.00           O  
HETATM   41  S   UNL     1       2.092  -1.733  -0.601  1.00  0.00           S  
HETATM   42  H   UNL     1      -4.465   2.845   0.615  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.915   2.626   1.462  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.452  -5.464   1.900  1.00  0.00           H  
HETATM   45  H   UNL     1      -8.953  -4.510   1.822  1.00  0.00           H  
HETATM   46  H   UNL     1      -8.689  -5.847   0.678  1.00  0.00           H  
HETATM   47  H   UNL     1      10.400   0.475  -2.663  1.00  0.00           H  
HETATM   48  H   UNL     1       8.509   1.940  -2.095  1.00  0.00           H  
HETATM   49  H   UNL     1       0.185  -2.645   0.277  1.00  0.00           H  
HETATM   50  H   UNL     1      10.679  -1.692  -1.546  1.00  0.00           H  
HETATM   51  H   UNL     1       6.876   1.258  -0.411  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.963  -2.901  -0.858  1.00  0.00           H  
HETATM   53  H   UNL     1       7.388  -3.228   1.974  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.793   1.385   1.322  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.273   0.982  -0.989  1.00  0.00           H  
HETATM   56  H   UNL     1       4.705  -0.717  -0.147  1.00  0.00           H  
HETATM   57  H   UNL     1       4.555  -2.271   0.708  1.00  0.00           H  
HETATM   58  H   UNL     1      -0.233   5.975  -0.062  1.00  0.00           H  
HETATM   59  H   UNL     1      -0.664   7.365  -1.087  1.00  0.00           H  
HETATM   60  H   UNL     1      -2.688   6.807   2.467  1.00  0.00           H  
HETATM   61  H   UNL     1      -1.414   5.649   2.013  1.00  0.00           H  
HETATM   62  H   UNL     1       5.871   0.249   1.817  1.00  0.00           H  
HETATM   63  H   UNL     1       5.721  -1.305   2.671  1.00  0.00           H  
HETATM   64  H   UNL     1      -2.798   6.340  -1.679  1.00  0.00           H  
HETATM   65  H   UNL     1      -1.513   5.137  -1.959  1.00  0.00           H  
HETATM   66  H   UNL     1      -3.568   4.569   1.652  1.00  0.00           H  
HETATM   67  H   UNL     1      -4.159   5.964   0.713  1.00  0.00           H  
HETATM   68  H   UNL     1      -6.192  -3.316   1.671  1.00  0.00           H  
HETATM   69  H   UNL     1      -7.756  -2.468   1.590  1.00  0.00           H  
HETATM   70  H   UNL     1      -7.011  -5.635  -1.043  1.00  0.00           H  
HETATM   71  H   UNL     1      -5.757  -5.169   0.131  1.00  0.00           H  
HETATM   72  H   UNL     1      -7.192  -1.614  -0.659  1.00  0.00           H  
HETATM   73  H   UNL     1      -5.938  -1.147   0.515  1.00  0.00           H  
HETATM   74  H   UNL     1      -5.192  -4.313  -2.118  1.00  0.00           H  
HETATM   75  H   UNL     1      -6.756  -3.466  -2.199  1.00  0.00           H  
HETATM   76  H   UNL     1      -5.507  -1.235  -2.353  1.00  0.00           H  
HETATM   77  H   UNL     1      -4.075  -2.290  -2.424  1.00  0.00           H  
HETATM   78  H   UNL     1       3.439  -0.250   2.334  1.00  0.00           H  
HETATM   79  H   UNL     1       1.110  -0.070   2.381  1.00  0.00           H  
HETATM   80  H   UNL     1       9.431  -3.333   0.457  1.00  0.00           H  
CONECT    1    2   33   14                                            
CONECT    2    3    1   42   43                                       
CONECT    3   39    2    4    4                                       
CONECT    4    3    3                                                 
CONECT    5   37   44   45   46                                       
CONECT    6    7    9    9   47                                       
CONECT    7   10   10    6   48                                       
CONECT    8   27   11   11   49                                       
CONECT    9    6    6   30   50                                       
CONECT   10    7    7   31   51                                       
CONECT   11    8    8   32   52                                       
CONECT   12   28   28   36   53                                       
CONECT   13   27   27   33   54                                       
CONECT   14    1   29   29   55                                       
CONECT   15   34   18   56   57                                       
CONECT   16   40   19   58   59                                       
CONECT   17   40   20   60   61                                       
CONECT   18   15   28   62   63                                       
CONECT   19   16   39   64   65                                       
CONECT   20   17   39   66   67                                       
CONECT   21   37   23   68   69                                       
CONECT   22   24   37   70   71                                       
CONECT   23   38   21   72   73                                       
CONECT   24   22   38   74   75                                       
CONECT   25   29   38   76   77                                       
CONECT   26   41   41   34   35                                       
CONECT   27   35   13   13    8                                       
CONECT   28   18   31   12   12                                       
CONECT   29   32   14   14   25                                       
CONECT   30   31   31   36    9                                       
CONECT   31   10   28   30   30                                       
CONECT   32   33   33   11   29                                       
CONECT   33   13    1   32   32                                       
CONECT   34   15   26   78                                            
CONECT   35   26   27   79                                            
CONECT   36   12   30   80                                            
CONECT   37   22    5   21                                            
CONECT   38   24   25   23                                            
CONECT   39   20   19    3                                            
CONECT   40   17   16                                                 
CONECT   41   26   26                                                 
CONECT   42    2                                                      
CONECT   43    2                                                      
CONECT   44    5                                                      
CONECT   45    5                                                      
CONECT   46    5                                                      
CONECT   47    6                                                      
CONECT   48    7                                                      
CONECT   49    8                                                      
CONECT   50    9                                                      
CONECT   51   10                                                      
CONECT   52   11                                                      
CONECT   53   12                                                      
CONECT   54   13                                                      
CONECT   55   14                                                      
CONECT   56   15                                                      
CONECT   57   15                                                      
CONECT   58   16                                                      
CONECT   59   16                                                      
CONECT   60   17                                                      
CONECT   61   17                                                      
CONECT   62   18                                                      
CONECT   63   18                                                      
CONECT   64   19                                                      
CONECT   65   19                                                      
CONECT   66   20                                                      
CONECT   67   20                                                      
CONECT   68   21                                                      
CONECT   69   21                                                      
CONECT   70   22                                                      
CONECT   71   22                                                      
CONECT   72   23                                                      
CONECT   73   23                                                      
CONECT   74   24                                                      
CONECT   75   24                                                      
CONECT   76   25                                                      
CONECT   77   25                                                      
CONECT   78   34                                                      
CONECT   79   35                                                      
CONECT   80   36                                                      
MASTER        0    0    0    0    0    0    0    0   80    0   80    0
END
