COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -3.481  -3.540   0.120  1.00  0.00           N  
HETATM    2  N   UNL     1      -1.508   0.197  -0.408  1.00  0.00           N  
HETATM    3  C   UNL     1      -2.649  -2.513  -0.149  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.200  -4.958  -0.117  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.548  -1.716   0.726  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.994   1.403  -0.526  1.00  0.00           C  
HETATM    7  C   UNL     1       0.989   0.378  -1.337  1.00  0.00           C  
HETATM    8  C   UNL     1       1.344  -0.448  -0.095  1.00  0.00           C  
HETATM    9  C   UNL     1       5.964  -0.358   1.410  1.00  0.00           C  
HETATM   10  C   UNL     1       3.015  -0.172   1.607  1.00  0.00           C  
HETATM   11  C   UNL     1       2.493   0.623  -1.528  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.499   3.891  -0.105  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.495   1.067   0.510  1.00  0.00           C  
HETATM   14  C   UNL     1       2.744  -0.663  -0.721  1.00  0.00           C  
HETATM   15  C   UNL     1       5.068  -0.572   0.218  1.00  0.00           C  
HETATM   16  C   UNL     1       7.425  -0.520   0.985  1.00  0.00           C  
HETATM   17  C   UNL     1       1.655   0.414   1.154  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.744   2.526  -0.114  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.618   4.515   0.423  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.739   0.015   0.101  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.283  -1.362   0.217  1.00  0.00           C  
HETATM   22  C   UNL     1       0.358  -0.448  -2.460  1.00  0.00           C  
HETATM   23  N   UNL     1      -4.657  -3.017   0.671  1.00  0.00           N  
HETATM   24  N   UNL     1       3.730  -0.478   0.355  1.00  0.00           N  
HETATM   25  N   UNL     1      -3.001   2.340   0.406  1.00  0.00           N  
HETATM   26  N   UNL     1      -3.514   3.600   0.728  1.00  0.00           N  
HETATM   27  O   UNL     1       0.250   1.565  -1.041  1.00  0.00           O  
HETATM   28  O   UNL     1       5.550  -0.829  -0.865  1.00  0.00           O  
HETATM   29  H   UNL     1      -1.660  -2.588  -0.576  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.536  -5.233  -1.117  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.128  -5.135  -0.033  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.727  -5.561   0.622  1.00  0.00           H  
HETATM   33  H   UNL     1      -5.295  -1.033   1.101  1.00  0.00           H  
HETATM   34  H   UNL     1       0.739  -1.337   0.083  1.00  0.00           H  
HETATM   35  H   UNL     1       5.810   0.647   1.805  1.00  0.00           H  
HETATM   36  H   UNL     1       5.726  -1.091   2.180  1.00  0.00           H  
HETATM   37  H   UNL     1       3.569   0.562   2.191  1.00  0.00           H  
HETATM   38  H   UNL     1       2.862  -1.081   2.189  1.00  0.00           H  
HETATM   39  H   UNL     1       2.816   0.555  -2.567  1.00  0.00           H  
HETATM   40  H   UNL     1       2.853   1.525  -1.033  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.599   4.380  -0.447  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.482   0.901   0.915  1.00  0.00           H  
HETATM   43  H   UNL     1       2.872  -1.577  -1.302  1.00  0.00           H  
HETATM   44  H   UNL     1       8.074  -0.364   1.848  1.00  0.00           H  
HETATM   45  H   UNL     1       7.580  -1.524   0.591  1.00  0.00           H  
HETATM   46  H   UNL     1       7.663   0.214   0.215  1.00  0.00           H  
HETATM   47  H   UNL     1       1.752   1.466   0.888  1.00  0.00           H  
HETATM   48  H   UNL     1       0.894   0.276   1.923  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.737   5.579   0.562  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.605  -0.836  -2.128  1.00  0.00           H  
HETATM   51  H   UNL     1       0.213   0.183  -3.337  1.00  0.00           H  
HETATM   52  H   UNL     1       1.016  -1.278  -2.714  1.00  0.00           H  
CONECT    1    3    4   23                                            
CONECT    2   20    6    6                                            
CONECT    3   21   21    1   29                                       
CONECT    4    1   30   31   32                                       
CONECT    5   23   23   21   33                                       
CONECT    6    2    2   27   18                                       
CONECT    7   27   22    8   11                                       
CONECT    8    7   14   17   34                                       
CONECT    9   15   16   35   36                                       
CONECT   10   24   17   37   38                                       
CONECT   11   14    7   39   40                                       
CONECT   12   19   18   18   41                                       
CONECT   13   20   20   25   42                                       
CONECT   14    8   24   11   43                                       
CONECT   15   24    9   28   28                                       
CONECT   16    9   44   45   46                                       
CONECT   17   10    8   47   48                                       
CONECT   18    6   25   12   12                                       
CONECT   19   26   26   12   49                                       
CONECT   20   13   13   21    2                                       
CONECT   21   20    3    3    5                                       
CONECT   22    7   50   51   52                                       
CONECT   23    1    5    5                                            
CONECT   24   14   15   10                                            
CONECT   25   18   26   13                                            
CONECT   26   25   19   19                                            
CONECT   27    6    7                                                 
CONECT   28   15   15                                                 
CONECT   29    3                                                      
CONECT   30    4                                                      
CONECT   31    4                                                      
CONECT   32    4                                                      
CONECT   33    5                                                      
CONECT   34    8                                                      
CONECT   35    9                                                      
CONECT   36    9                                                      
CONECT   37   10                                                      
CONECT   38   10                                                      
CONECT   39   11                                                      
CONECT   40   11                                                      
CONECT   41   12                                                      
CONECT   42   13                                                      
CONECT   43   14                                                      
CONECT   44   16                                                      
CONECT   45   16                                                      
CONECT   46   16                                                      
CONECT   47   17                                                      
CONECT   48   17                                                      
CONECT   49   19                                                      
CONECT   50   22                                                      
CONECT   51   22                                                      
CONECT   52   22                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
