COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -4.492  -4.760   0.362  1.00  0.00           O  
HETATM    2  C   UNL     1      -5.002  -3.799  -0.564  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.750  -2.388  -0.026  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.405  -1.362  -0.955  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.099   0.048  -0.446  1.00  0.00           C  
HETATM    6  N   UNL     1      -3.645   0.252  -0.409  1.00  0.00           N  
HETATM    7  C   UNL     1      -3.000  -0.692   0.513  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.243  -2.124   0.032  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.334   1.566  -0.076  1.00  0.00           C  
HETATM   10  N   UNL     1      -4.301   2.438   0.163  1.00  0.00           N  
HETATM   11  C   UNL     1      -4.002   3.689   0.480  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.684   4.088   0.562  1.00  0.00           C  
HETATM   13  N   UNL     1      -1.709   3.224   0.325  1.00  0.00           N  
HETATM   14  C   UNL     1      -1.996   1.971   0.014  1.00  0.00           C  
HETATM   15  O   UNL     1      -0.998   1.082  -0.224  1.00  0.00           O  
HETATM   16  C   UNL     1       0.342   1.566  -0.114  1.00  0.00           C  
HETATM   17  C   UNL     1       1.339   0.843  -1.037  1.00  0.00           C  
HETATM   18  N   UNL     1       1.557  -0.087   0.092  1.00  0.00           N  
HETATM   19  C   UNL     1       1.129   0.950   1.056  1.00  0.00           C  
HETATM   20  C   UNL     1       2.904  -0.380   0.243  1.00  0.00           C  
HETATM   21  C   UNL     1       3.306  -1.250   1.267  1.00  0.00           C  
HETATM   22  C   UNL     1       4.626  -1.547   1.426  1.00  0.00           C  
HETATM   23  C   UNL     1       5.554  -0.960   0.542  1.00  0.00           C  
HETATM   24  C   UNL     1       6.928  -1.223   0.650  1.00  0.00           C  
HETATM   25  C   UNL     1       7.797  -0.638  -0.222  1.00  0.00           C  
HETATM   26  C   UNL     1       7.338   0.218  -1.220  1.00  0.00           C  
HETATM   27  C   UNL     1       6.011   0.495  -1.352  1.00  0.00           C  
HETATM   28  C   UNL     1       5.086  -0.090  -0.472  1.00  0.00           C  
HETATM   29  N   UNL     1       3.776   0.161  -0.583  1.00  0.00           N  
HETATM   30  H   UNL     1      -4.617  -5.678   0.085  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.498  -3.917  -1.524  1.00  0.00           H  
HETATM   32  H   UNL     1      -6.073  -3.952  -0.695  1.00  0.00           H  
HETATM   33  H   UNL     1      -5.176  -2.299   0.973  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.008  -1.479  -1.964  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.484  -1.518  -0.968  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.551   0.781  -1.113  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.508   0.169   0.557  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.928  -0.496   0.542  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.419  -0.568   1.511  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.777  -2.825   0.725  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.812  -2.253  -0.961  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.792   4.399   0.675  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.447   5.109   0.820  1.00  0.00           H  
HETATM   44  H   UNL     1       0.406   2.653  -0.165  1.00  0.00           H  
HETATM   45  H   UNL     1       0.876   0.378  -1.906  1.00  0.00           H  
HETATM   46  H   UNL     1       2.216   1.440  -1.289  1.00  0.00           H  
HETATM   47  H   UNL     1       1.944   1.578   1.416  1.00  0.00           H  
HETATM   48  H   UNL     1       0.497   0.571   1.859  1.00  0.00           H  
HETATM   49  H   UNL     1       2.570  -1.684   1.928  1.00  0.00           H  
HETATM   50  H   UNL     1       4.952  -2.215   2.210  1.00  0.00           H  
HETATM   51  H   UNL     1       7.296  -1.886   1.419  1.00  0.00           H  
HETATM   52  H   UNL     1       8.854  -0.841  -0.139  1.00  0.00           H  
HETATM   53  H   UNL     1       8.046   0.670  -1.900  1.00  0.00           H  
HETATM   54  H   UNL     1       5.672   1.162  -2.131  1.00  0.00           H  
CONECT    1    2   30                                                 
CONECT    2    1    3   31   32                                       
CONECT    3    2    8    4   33                                       
CONECT    4    3    5   34   35                                       
CONECT    5    4    6   36   37                                       
CONECT    6    7    5    9                                            
CONECT    7    8    6   38   39                                       
CONECT    8    3    7   40   41                                       
CONECT    9    6   10   10   14                                       
CONECT   10    9    9   11                                            
CONECT   11   10   12   12   42                                       
CONECT   12   11   11   13   43                                       
CONECT   13   14   14   12                                            
CONECT   14    9   15   13   13                                       
CONECT   15   14   16                                                 
CONECT   16   15   17   19   44                                       
CONECT   17   16   18   45   46                                       
CONECT   18   17   19   20                                            
CONECT   19   16   18   47   48                                       
CONECT   20   18   29   29   21                                       
CONECT   21   20   22   22   49                                       
CONECT   22   21   21   23   50                                       
CONECT   23   28   22   24   24                                       
CONECT   24   23   23   25   51                                       
CONECT   25   26   26   24   52                                       
CONECT   26   27   25   25   53                                       
CONECT   27   28   28   26   54                                       
CONECT   28   29   27   27   23                                       
CONECT   29   20   20   28                                            
CONECT   30    1                                                      
CONECT   31    2                                                      
CONECT   32    2                                                      
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    4                                                      
CONECT   36    5                                                      
CONECT   37    5                                                      
CONECT   38    7                                                      
CONECT   39    7                                                      
CONECT   40    8                                                      
CONECT   41    8                                                      
CONECT   42   11                                                      
CONECT   43   12                                                      
CONECT   44   16                                                      
CONECT   45   17                                                      
CONECT   46   17                                                      
CONECT   47   19                                                      
CONECT   48   19                                                      
CONECT   49   21                                                      
CONECT   50   22                                                      
CONECT   51   24                                                      
CONECT   52   25                                                      
CONECT   53   26                                                      
CONECT   54   27                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
