COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.273  -0.481  -0.172  1.00  0.00           C  
HETATM    2  C   UNL     1       2.649  -0.348  -0.221  1.00  0.00           C  
HETATM    3  C   UNL     1       3.720   0.380   0.293  1.00  0.00           C  
HETATM    4  C   UNL     1       4.707   2.388   1.099  1.00  0.00           C  
HETATM    5  C   UNL     1       4.766   2.397   2.628  1.00  0.00           C  
HETATM    6  C   UNL     1       4.957   0.968   3.139  1.00  0.00           C  
HETATM    7  C   UNL     1       4.641   3.827   0.582  1.00  0.00           C  
HETATM    8  C   UNL     1       4.709   3.824  -0.946  1.00  0.00           C  
HETATM    9  C   UNL     1       4.643   5.262  -1.462  1.00  0.00           C  
HETATM   10  C   UNL     1       4.963  -0.218   0.418  1.00  0.00           C  
HETATM   11  C   UNL     1       5.139  -1.534   0.033  1.00  0.00           C  
HETATM   12  C   UNL     1       4.076  -2.257  -0.477  1.00  0.00           C  
HETATM   13  C   UNL     1       4.273  -3.694  -0.888  1.00  0.00           C  
HETATM   14  C   UNL     1       3.934  -3.851  -2.371  1.00  0.00           C  
HETATM   15  C   UNL     1       5.731  -4.096  -0.653  1.00  0.00           C  
HETATM   16  C   UNL     1       3.356  -4.593  -0.057  1.00  0.00           C  
HETATM   17  C   UNL     1       2.832  -1.670  -0.599  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.050   0.171  -0.196  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.253  -0.454  -0.025  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.474  -1.925   0.222  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.591   0.311  -0.005  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.448   0.852  -0.959  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.882   2.094  -2.940  1.00  0.00           C  
HETATM   24  C   UNL     1      -6.816   0.660  -0.848  1.00  0.00           C  
HETATM   25  C   UNL     1      -7.329  -0.068   0.209  1.00  0.00           C  
HETATM   26  C   UNL     1      -6.477  -0.607   1.162  1.00  0.00           C  
HETATM   27  C   UNL     1      -8.406  -1.477   2.249  1.00  0.00           C  
HETATM   28  C   UNL     1      -5.108  -0.419   1.055  1.00  0.00           C  
HETATM   29  N   UNL     1       1.389   0.252  -0.349  1.00  0.00           N  
HETATM   30  N   UNL     1      -3.205   0.498  -0.118  1.00  0.00           N  
HETATM   31  N   UNL     1      -2.542   1.712  -0.350  1.00  0.00           N  
HETATM   32  N   UNL     1      -1.275   1.482  -0.385  1.00  0.00           N  
HETATM   33  O   UNL     1       0.356  -1.681   0.014  1.00  0.00           O  
HETATM   34  O   UNL     1       3.545   1.675   0.671  1.00  0.00           O  
HETATM   35  O   UNL     1      -4.944   1.568  -1.999  1.00  0.00           O  
HETATM   36  O   UNL     1      -6.986  -1.322   2.201  1.00  0.00           O  
HETATM   37  H   UNL     1       5.599   1.901   0.704  1.00  0.00           H  
HETATM   38  H   UNL     1       5.602   3.015   2.956  1.00  0.00           H  
HETATM   39  H   UNL     1       3.836   2.803   3.024  1.00  0.00           H  
HETATM   40  H   UNL     1       4.998   0.974   4.228  1.00  0.00           H  
HETATM   41  H   UNL     1       4.121   0.350   2.811  1.00  0.00           H  
HETATM   42  H   UNL     1       5.887   0.561   2.742  1.00  0.00           H  
HETATM   43  H   UNL     1       3.707   4.286   0.904  1.00  0.00           H  
HETATM   44  H   UNL     1       5.482   4.395   0.982  1.00  0.00           H  
HETATM   45  H   UNL     1       5.643   3.365  -1.268  1.00  0.00           H  
HETATM   46  H   UNL     1       3.868   3.256  -1.345  1.00  0.00           H  
HETATM   47  H   UNL     1       3.708   5.721  -1.141  1.00  0.00           H  
HETATM   48  H   UNL     1       5.483   5.831  -1.063  1.00  0.00           H  
HETATM   49  H   UNL     1       4.691   5.260  -2.551  1.00  0.00           H  
HETATM   50  H   UNL     1       5.795   0.344   0.816  1.00  0.00           H  
HETATM   51  H   UNL     1       6.109  -1.999   0.131  1.00  0.00           H  
HETATM   52  H   UNL     1       4.587  -3.210  -2.964  1.00  0.00           H  
HETATM   53  H   UNL     1       4.076  -4.890  -2.669  1.00  0.00           H  
HETATM   54  H   UNL     1       2.895  -3.564  -2.539  1.00  0.00           H  
HETATM   55  H   UNL     1       5.973  -3.985   0.404  1.00  0.00           H  
HETATM   56  H   UNL     1       5.873  -5.135  -0.950  1.00  0.00           H  
HETATM   57  H   UNL     1       6.384  -3.456  -1.245  1.00  0.00           H  
HETATM   58  H   UNL     1       2.317  -4.306  -0.224  1.00  0.00           H  
HETATM   59  H   UNL     1       3.498  -5.632  -0.354  1.00  0.00           H  
HETATM   60  H   UNL     1       3.598  -4.481   1.000  1.00  0.00           H  
HETATM   61  H   UNL     1       2.003  -2.237  -0.997  1.00  0.00           H  
HETATM   62  H   UNL     1      -2.543  -2.107   1.294  1.00  0.00           H  
HETATM   63  H   UNL     1      -3.399  -2.239  -0.260  1.00  0.00           H  
HETATM   64  H   UNL     1      -1.639  -2.492  -0.190  1.00  0.00           H  
HETATM   65  H   UNL     1      -6.572   2.766  -2.429  1.00  0.00           H  
HETATM   66  H   UNL     1      -5.349   2.643  -3.717  1.00  0.00           H  
HETATM   67  H   UNL     1      -6.441   1.275  -3.393  1.00  0.00           H  
HETATM   68  H   UNL     1      -7.482   1.080  -1.587  1.00  0.00           H  
HETATM   69  H   UNL     1      -8.396  -0.216   0.294  1.00  0.00           H  
HETATM   70  H   UNL     1      -8.677  -2.066   3.125  1.00  0.00           H  
HETATM   71  H   UNL     1      -8.876  -0.495   2.310  1.00  0.00           H  
HETATM   72  H   UNL     1      -8.746  -1.987   1.348  1.00  0.00           H  
HETATM   73  H   UNL     1      -4.445  -0.844   1.794  1.00  0.00           H  
HETATM   74  H   UNL     1       1.321   1.195  -0.566  1.00  0.00           H  
CONECT    1   33   33   18   29                                       
CONECT    2   17   29    3    3                                       
CONECT    3    2    2   10   34                                       
CONECT    4    5   34    7   37                                       
CONECT    5    6    4   38   39                                       
CONECT    6    5   40   41   42                                       
CONECT    7    4    8   43   44                                       
CONECT    8    9    7   45   46                                       
CONECT    9    8   47   48   49                                       
CONECT   10   11   11    3   50                                       
CONECT   11   12   10   10   51                                       
CONECT   12   13   17   17   11                                       
CONECT   13   16   15   14   12                                       
CONECT   14   13   52   53   54                                       
CONECT   15   13   55   56   57                                       
CONECT   16   13   58   59   60                                       
CONECT   17   12   12    2   61                                       
CONECT   18   19   19    1   32                                       
CONECT   19   20   18   18   30                                       
CONECT   20   19   62   63   64                                       
CONECT   21   22   22   28   30                                       
CONECT   22   24   35   21   21                                       
CONECT   23   35   65   66   67                                       
CONECT   24   25   25   22   68                                       
CONECT   25   24   24   26   69                                       
CONECT   26   25   36   28   28                                       
CONECT   27   36   70   71   72                                       
CONECT   28   26   26   21   73                                       
CONECT   29    1    2   74                                            
CONECT   30   19   21   31                                            
CONECT   31   30   32   32                                            
CONECT   32   18   31   31                                            
CONECT   33    1    1                                                 
CONECT   34    3    4                                                 
CONECT   35   23   22                                                 
CONECT   36   27   26                                                 
CONECT   37    4                                                      
CONECT   38    5                                                      
CONECT   39    5                                                      
CONECT   40    6                                                      
CONECT   41    6                                                      
CONECT   42    6                                                      
CONECT   43    7                                                      
CONECT   44    7                                                      
CONECT   45    8                                                      
CONECT   46    8                                                      
CONECT   47    9                                                      
CONECT   48    9                                                      
CONECT   49    9                                                      
CONECT   50   10                                                      
CONECT   51   11                                                      
CONECT   52   14                                                      
CONECT   53   14                                                      
CONECT   54   14                                                      
CONECT   55   15                                                      
CONECT   56   15                                                      
CONECT   57   15                                                      
CONECT   58   16                                                      
CONECT   59   16                                                      
CONECT   60   16                                                      
CONECT   61   17                                                      
CONECT   62   20                                                      
CONECT   63   20                                                      
CONECT   64   20                                                      
CONECT   65   23                                                      
CONECT   66   23                                                      
CONECT   67   23                                                      
CONECT   68   24                                                      
CONECT   69   25                                                      
CONECT   70   27                                                      
CONECT   71   27                                                      
CONECT   72   27                                                      
CONECT   73   28                                                      
CONECT   74   29                                                      
MASTER        0    0    0    0    0    0    0    0   74    0   74    0
END
