COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -7.227   3.802  -0.686  1.00  0.00           N  
HETATM    2  C   UNL     1      -6.459   2.731  -0.293  1.00  0.00           C  
HETATM    3  N   UNL     1      -6.982   1.458  -0.333  1.00  0.00           N  
HETATM    4  C   UNL     1      -6.163   0.356  -0.053  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.695  -0.759   0.586  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.897  -1.850   0.865  1.00  0.00           C  
HETATM    7  C   UNL     1       5.912  -1.768  -0.914  1.00  0.00           C  
HETATM    8  C   UNL     1       6.704  -0.687  -0.582  1.00  0.00           C  
HETATM    9  C   UNL     1       6.166   0.389   0.116  1.00  0.00           C  
HETATM   10  N   UNL     1       6.977   1.482   0.448  1.00  0.00           N  
HETATM   11  C   UNL     1       6.488   2.763   0.332  1.00  0.00           C  
HETATM   12  N   UNL     1       5.249   2.978  -0.226  1.00  0.00           N  
HETATM   13  N   UNL     1      -5.236   2.921   0.117  1.00  0.00           N  
HETATM   14  C   UNL     1      -4.828   0.376  -0.419  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.014  -0.724  -0.139  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.556  -1.841   0.511  1.00  0.00           C  
HETATM   17  O   UNL     1      -3.773  -2.915   0.786  1.00  0.00           O  
HETATM   18  O   UNL     1       3.796  -2.851  -0.885  1.00  0.00           O  
HETATM   19  C   UNL     1       4.574  -1.788  -0.554  1.00  0.00           C  
HETATM   20  C   UNL     1       4.025  -0.710   0.154  1.00  0.00           C  
HETATM   21  C   UNL     1       4.831   0.383   0.482  1.00  0.00           C  
HETATM   22  N   UNL     1       7.198   3.773   0.750  1.00  0.00           N  
HETATM   23  C   UNL     1      -2.592  -0.710  -0.525  1.00  0.00           C  
HETATM   24  N   UNL     1      -1.841  -1.731  -0.265  1.00  0.00           N  
HETATM   25  C   UNL     1      -0.427  -1.717  -0.649  1.00  0.00           C  
HETATM   26  C   UNL     1       0.444  -1.748   0.609  1.00  0.00           C  
HETATM   27  N   UNL     1       1.857  -1.734   0.226  1.00  0.00           N  
HETATM   28  C   UNL     1       2.603  -0.724   0.540  1.00  0.00           C  
HETATM   29  H   UNL     1      -6.859   4.699  -0.658  1.00  0.00           H  
HETATM   30  H   UNL     1      -8.135   3.660  -0.995  1.00  0.00           H  
HETATM   31  H   UNL     1      -7.917   1.324  -0.554  1.00  0.00           H  
HETATM   32  H   UNL     1      -7.739  -0.772   0.865  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.317  -2.712   1.361  1.00  0.00           H  
HETATM   34  H   UNL     1       6.336  -2.599  -1.459  1.00  0.00           H  
HETATM   35  H   UNL     1       7.746  -0.677  -0.865  1.00  0.00           H  
HETATM   36  H   UNL     1       7.884   1.336   0.761  1.00  0.00           H  
HETATM   37  H   UNL     1       4.721   2.226  -0.538  1.00  0.00           H  
HETATM   38  H   UNL     1       4.904   3.881  -0.308  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.868   3.818   0.145  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.417   1.241  -0.919  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.336  -2.872   1.648  1.00  0.00           H  
HETATM   42  H   UNL     1       3.781  -3.551  -0.219  1.00  0.00           H  
HETATM   43  H   UNL     1       4.415   1.219   1.024  1.00  0.00           H  
HETATM   44  H   UNL     1       8.100   3.629   1.077  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.177   0.153  -1.026  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.209  -2.590  -1.263  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.213  -0.811  -1.216  1.00  0.00           H  
HETATM   48  H   UNL     1       0.225  -0.874   1.224  1.00  0.00           H  
HETATM   49  H   UNL     1       0.230  -2.654   1.177  1.00  0.00           H  
HETATM   50  H   UNL     1       2.184   0.109   1.085  1.00  0.00           H  
CONECT    1    2   29   30                                            
CONECT    2    3    1   13   13                                       
CONECT    3    4    2   31                                            
CONECT    4   14   14    5    3                                       
CONECT    5    6    6    4   32                                       
CONECT    6   16    5    5   33                                       
CONECT    7    8    8   19   34                                       
CONECT    8    9    7    7   35                                       
CONECT    9   10   21   21    8                                       
CONECT   10   11    9   36                                            
CONECT   11   12   22   22   10                                       
CONECT   12   11   37   38                                            
CONECT   13    2    2   39                                            
CONECT   14   15    4    4   40                                       
CONECT   15   23   16   16   14                                       
CONECT   16   17   15   15    6                                       
CONECT   17   16   41                                                 
CONECT   18   19   42                                                 
CONECT   19   20   20    7   18                                       
CONECT   20   21   28   19   19                                       
CONECT   21    9    9   20   43                                       
CONECT   22   11   11   44                                            
CONECT   23   24   24   15   45                                       
CONECT   24   25   23   23                                            
CONECT   25   26   24   46   47                                       
CONECT   26   27   25   48   49                                       
CONECT   27   28   28   26                                            
CONECT   28   20   27   27   50                                       
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    3                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36   10                                                      
CONECT   37   12                                                      
CONECT   38   12                                                      
CONECT   39   13                                                      
CONECT   40   14                                                      
CONECT   41   17                                                      
CONECT   42   18                                                      
CONECT   43   21                                                      
CONECT   44   22                                                      
CONECT   45   23                                                      
CONECT   46   25                                                      
CONECT   47   25                                                      
CONECT   48   26                                                      
CONECT   49   26                                                      
CONECT   50   28                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
