COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -6.993  -1.069   0.443  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.958  -0.696   1.788  1.00  0.00           C  
HETATM    3  C   UNL     1      -7.706  -1.382   2.702  1.00  0.00           C  
HETATM    4  C   UNL     1      -8.501  -2.449   2.305  1.00  0.00           C  
HETATM    5  C   UNL     1      -8.550  -2.834   0.983  1.00  0.00           C  
HETATM    6  C   UNL     1      -7.797  -2.149   0.035  1.00  0.00           C  
HETATM    7  N   UNL     1      -7.635  -2.285  -1.326  1.00  0.00           N  
HETATM    8  C   UNL     1      -6.764  -1.336  -1.787  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.344  -0.567  -0.771  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.386   0.593  -0.860  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.167   0.163  -0.698  1.00  0.00           C  
HETATM   12  N   UNL     1      -3.233   1.293  -0.785  1.00  0.00           N  
HETATM   13  C   UNL     1      -1.860   0.867  -0.481  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.077   1.909  -0.456  1.00  0.00           C  
HETATM   15  C   UNL     1       0.363   1.459  -0.202  1.00  0.00           C  
HETATM   16  C   UNL     1       0.795   0.487  -1.305  1.00  0.00           C  
HETATM   17  C   UNL     1       0.433   1.055  -2.653  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.380   0.399  -3.443  1.00  0.00           C  
HETATM   19  C   UNL     1       1.271   2.658  -0.204  1.00  0.00           C  
HETATM   20  C   UNL     1       0.845   3.836   0.456  1.00  0.00           C  
HETATM   21  O   UNL     1       1.505   4.854   0.369  1.00  0.00           O  
HETATM   22  O   UNL     1      -0.292   3.829   1.183  1.00  0.00           O  
HETATM   23  C   UNL     1      -0.721   5.078   1.727  1.00  0.00           C  
HETATM   24  C   UNL     1       2.464   2.652  -0.804  1.00  0.00           C  
HETATM   25  O   UNL     1       2.948   1.586  -1.461  1.00  0.00           O  
HETATM   26  C   UNL     1       2.316   0.301  -1.213  1.00  0.00           C  
HETATM   27  O   UNL     1       2.667  -0.164   0.092  1.00  0.00           O  
HETATM   28  C   UNL     1       4.053  -0.477   0.245  1.00  0.00           C  
HETATM   29  O   UNL     1       4.387  -1.582  -0.597  1.00  0.00           O  
HETATM   30  C   UNL     1       5.764  -1.963  -0.540  1.00  0.00           C  
HETATM   31  C   UNL     1       6.010  -3.131  -1.497  1.00  0.00           C  
HETATM   32  O   UNL     1       5.792  -2.700  -2.841  1.00  0.00           O  
HETATM   33  C   UNL     1       6.115  -2.389   0.888  1.00  0.00           C  
HETATM   34  O   UNL     1       7.505  -2.715   0.960  1.00  0.00           O  
HETATM   35  C   UNL     1       5.809  -1.235   1.847  1.00  0.00           C  
HETATM   36  O   UNL     1       6.065  -1.649   3.191  1.00  0.00           O  
HETATM   37  C   UNL     1       4.335  -0.843   1.704  1.00  0.00           C  
HETATM   38  O   UNL     1       4.056   0.280   2.541  1.00  0.00           O  
HETATM   39  H   UNL     1      -6.342   0.133   2.104  1.00  0.00           H  
HETATM   40  H   UNL     1      -7.678  -1.093   3.742  1.00  0.00           H  
HETATM   41  H   UNL     1      -9.086  -2.983   3.039  1.00  0.00           H  
HETATM   42  H   UNL     1      -9.171  -3.666   0.684  1.00  0.00           H  
HETATM   43  H   UNL     1      -8.072  -2.954  -1.875  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.462  -1.221  -2.818  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.478   1.065  -1.838  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.622   1.320  -0.082  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.075  -0.309   0.280  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.931  -0.564  -1.475  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.282   1.734  -1.691  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.839   0.373   0.490  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.517   0.174  -1.249  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.132   2.429  -1.412  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.393   2.581   0.342  1.00  0.00           H  
HETATM   54  H   UNL     1       0.423   0.960   0.765  1.00  0.00           H  
HETATM   55  H   UNL     1       0.298  -0.473  -1.165  1.00  0.00           H  
HETATM   56  H   UNL     1       0.845   2.002  -2.968  1.00  0.00           H  
HETATM   57  H   UNL     1       2.644  -0.421  -1.961  1.00  0.00           H  
HETATM   58  H   UNL     1      -0.640   0.806  -4.409  1.00  0.00           H  
HETATM   59  H   UNL     1      -0.792  -0.549  -3.128  1.00  0.00           H  
HETATM   60  H   UNL     1       3.067   3.547  -0.760  1.00  0.00           H  
HETATM   61  H   UNL     1       0.082   5.509   2.326  1.00  0.00           H  
HETATM   62  H   UNL     1      -0.975   5.761   0.916  1.00  0.00           H  
HETATM   63  H   UNL     1      -1.598   4.919   2.356  1.00  0.00           H  
HETATM   64  H   UNL     1       4.653   0.389  -0.036  1.00  0.00           H  
HETATM   65  H   UNL     1       3.705  -1.683   1.997  1.00  0.00           H  
HETATM   66  H   UNL     1       6.387  -1.117  -0.831  1.00  0.00           H  
HETATM   67  H   UNL     1       7.037  -3.479  -1.388  1.00  0.00           H  
HETATM   68  H   UNL     1       5.324  -3.945  -1.261  1.00  0.00           H  
HETATM   69  H   UNL     1       5.522  -3.261   1.164  1.00  0.00           H  
HETATM   70  H   UNL     1       5.931  -3.391  -3.503  1.00  0.00           H  
HETATM   71  H   UNL     1       7.798  -2.994   1.839  1.00  0.00           H  
HETATM   72  H   UNL     1       6.441  -0.380   1.602  1.00  0.00           H  
HETATM   73  H   UNL     1       5.893  -0.966   3.853  1.00  0.00           H  
HETATM   74  H   UNL     1       3.140   0.586   2.497  1.00  0.00           H  
CONECT    1    2    6    6    9                                       
CONECT    2    1    3    3   39                                       
CONECT    3    2    2    4   40                                       
CONECT    4    3    5    5   41                                       
CONECT    5    4    4    6   42                                       
CONECT    6    1    1    5    7                                       
CONECT    7    6    8   43                                            
CONECT    8    7    9    9   44                                       
CONECT    9    1    8    8   10                                       
CONECT   10    9   11   45   46                                       
CONECT   11   10   12   47   48                                       
CONECT   12   11   13   49                                            
CONECT   13   12   14   50   51                                       
CONECT   14   13   15   52   53                                       
CONECT   15   14   16   19   54                                       
CONECT   16   15   17   26   55                                       
CONECT   17   16   18   18   56                                       
CONECT   18   17   17   58   59                                       
CONECT   19   15   20   24   24                                       
CONECT   20   19   21   21   22                                       
CONECT   21   20   20                                                 
CONECT   22   20   23                                                 
CONECT   23   22   61   62   63                                       
CONECT   24   19   19   25   60                                       
CONECT   25   24   26                                                 
CONECT   26   16   25   27   57                                       
CONECT   27   26   28                                                 
CONECT   28   27   29   37   64                                       
CONECT   29   28   30                                                 
CONECT   30   29   31   33   66                                       
CONECT   31   30   32   67   68                                       
CONECT   32   31   70                                                 
CONECT   33   30   34   35   69                                       
CONECT   34   33   71                                                 
CONECT   35   33   36   37   72                                       
CONECT   36   35   73                                                 
CONECT   37   28   35   38   65                                       
CONECT   38   37   74                                                 
CONECT   39    2                                                      
CONECT   40    3                                                      
CONECT   41    4                                                      
CONECT   42    5                                                      
CONECT   43    7                                                      
CONECT   44    8                                                      
CONECT   45   10                                                      
CONECT   46   10                                                      
CONECT   47   11                                                      
CONECT   48   11                                                      
CONECT   49   12                                                      
CONECT   50   13                                                      
CONECT   51   13                                                      
CONECT   52   14                                                      
CONECT   53   14                                                      
CONECT   54   15                                                      
CONECT   55   16                                                      
CONECT   56   17                                                      
CONECT   57   26                                                      
CONECT   58   18                                                      
CONECT   59   18                                                      
CONECT   60   24                                                      
CONECT   61   23                                                      
CONECT   62   23                                                      
CONECT   63   23                                                      
CONECT   64   28                                                      
CONECT   65   37                                                      
CONECT   66   30                                                      
CONECT   67   31                                                      
CONECT   68   31                                                      
CONECT   69   33                                                      
CONECT   70   32                                                      
CONECT   71   34                                                      
CONECT   72   35                                                      
CONECT   73   36                                                      
CONECT   74   38                                                      
MASTER        0    0    0    0    0    0    0    0   74    0   74    0
END
