COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       1.730  -2.003  -2.307  1.00  0.00           O  
HETATM    2  C   UNL     1       2.380  -2.654  -1.516  1.00  0.00           C  
HETATM    3  C   UNL     1       3.510  -3.522  -2.006  1.00  0.00           C  
HETATM    4  N   UNL     1       2.095  -2.596  -0.200  1.00  0.00           N  
HETATM    5  C   UNL     1       1.000  -1.747   0.275  1.00  0.00           C  
HETATM    6  C   UNL     1       1.503  -0.324   0.414  1.00  0.00           C  
HETATM    7  C   UNL     1       2.835  -0.169   0.508  1.00  0.00           C  
HETATM    8  C   UNL     1       0.488  -2.293   1.593  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.391  -1.271   2.307  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.339  -0.640   1.321  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.667  -1.013   1.300  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.542  -0.419   0.399  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.087   0.554  -0.485  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.751   0.932  -0.471  1.00  0.00           C  
HETATM   15  O   UNL     1      -1.299   1.884  -1.330  1.00  0.00           O  
HETATM   16  C   UNL     1      -0.925   1.450  -2.639  1.00  0.00           C  
HETATM   17  O   UNL     1      -3.951   1.134  -1.362  1.00  0.00           O  
HETATM   18  C   UNL     1      -4.631   2.311  -0.920  1.00  0.00           C  
HETATM   19  O   UNL     1      -4.849  -0.792   0.380  1.00  0.00           O  
HETATM   20  C   UNL     1      -5.250  -1.797   1.313  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.875   0.326   0.435  1.00  0.00           C  
HETATM   22  C   UNL     1       0.568   0.711   0.438  1.00  0.00           C  
HETATM   23  C   UNL     1       0.848   2.053   0.469  1.00  0.00           C  
HETATM   24  C   UNL     1       2.001   2.745   0.525  1.00  0.00           C  
HETATM   25  C   UNL     1       3.275   2.273   0.597  1.00  0.00           C  
HETATM   26  C   UNL     1       3.638   0.931   0.618  1.00  0.00           C  
HETATM   27  O   UNL     1       4.833   0.706   0.753  1.00  0.00           O  
HETATM   28  O   UNL     1       4.274   3.188   0.653  1.00  0.00           O  
HETATM   29  H   UNL     1       4.435  -2.946  -2.012  1.00  0.00           H  
HETATM   30  H   UNL     1       3.622  -4.380  -1.343  1.00  0.00           H  
HETATM   31  H   UNL     1       3.291  -3.869  -3.015  1.00  0.00           H  
HETATM   32  H   UNL     1       2.615  -3.117   0.431  1.00  0.00           H  
HETATM   33  H   UNL     1       0.192  -1.767  -0.455  1.00  0.00           H  
HETATM   34  H   UNL     1       3.380  -1.102   0.494  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.093  -3.195   1.405  1.00  0.00           H  
HETATM   36  H   UNL     1       1.337  -2.543   2.231  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.961  -1.768   3.092  1.00  0.00           H  
HETATM   38  H   UNL     1       0.238  -0.498   2.750  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.027  -1.766   1.985  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.182   0.657  -2.561  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.804   1.075  -3.163  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.503   2.289  -3.193  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.901   3.052  -0.595  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.222   2.718  -1.741  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.289   2.059  -0.089  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.683  -2.710   1.131  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.060  -1.448   2.328  1.00  0.00           H  
HETATM   48  H   UNL     1      -6.314  -2.001   1.192  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.032   2.680   0.442  1.00  0.00           H  
HETATM   50  H   UNL     1       1.902   3.821   0.511  1.00  0.00           H  
HETATM   51  H   UNL     1       3.969   4.105   0.635  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    3    1    1    4                                       
CONECT    3    2   29   30   31                                       
CONECT    4    2    5   32                                            
CONECT    5    6    4    8   33                                       
CONECT    6    7    7   22    5                                       
CONECT    7   26    6    6   34                                       
CONECT    8    5    9   35   36                                       
CONECT    9   10    8   37   38                                       
CONECT   10   21   21   11    9                                       
CONECT   11   12   12   10   39                                       
CONECT   12   13   19   11   11                                       
CONECT   13   17   14   14   12                                       
CONECT   14   15   13   13   21                                       
CONECT   15   16   14                                                 
CONECT   16   15   40   41   42                                       
CONECT   17   18   13                                                 
CONECT   18   17   43   44   45                                       
CONECT   19   12   20                                                 
CONECT   20   19   46   47   48                                       
CONECT   21   14   22   10   10                                       
CONECT   22   23   23    6   21                                       
CONECT   23   24   22   22   49                                       
CONECT   24   25   25   23   50                                       
CONECT   25   28   24   24   26                                       
CONECT   26   25   27   27    7                                       
CONECT   27   26   26                                                 
CONECT   28   25   51                                                 
CONECT   29    3                                                      
CONECT   30    3                                                      
CONECT   31    3                                                      
CONECT   32    4                                                      
CONECT   33    5                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36    8                                                      
CONECT   37    9                                                      
CONECT   38    9                                                      
CONECT   39   11                                                      
CONECT   40   16                                                      
CONECT   41   16                                                      
CONECT   42   16                                                      
CONECT   43   18                                                      
CONECT   44   18                                                      
CONECT   45   18                                                      
CONECT   46   20                                                      
CONECT   47   20                                                      
CONECT   48   20                                                      
CONECT   49   23                                                      
CONECT   50   24                                                      
CONECT   51   28                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
