COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.550  -1.468   0.411  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.018   0.857   0.238  1.00  0.00           C  
HETATM    3  N   UNL     1      -1.809  -1.820   0.119  1.00  0.00           N  
HETATM    4  C   UNL     1      -3.056   1.694  -0.272  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.417   0.514  -0.088  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.774  -0.910  -0.136  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.955   2.194   0.218  1.00  0.00           C  
HETATM    8  C   UNL     1       1.272   0.095   0.804  1.00  0.00           C  
HETATM    9  CA  UNL     1       2.093   0.159  -0.485  1.00  0.00           C  
HETATM   10  C   UNL     1       3.551   0.334  -0.143  1.00  0.00           C  
HETATM   11  N   UNL     1      -0.127  -0.193   0.478  1.00  0.00           N  
HETATM   12  N   UNL     1       1.914  -1.087  -1.242  1.00  0.00           N  
HETATM   13  O   UNL     1      -3.909  -1.260  -0.398  1.00  0.00           O  
HETATM   14  O   UNL     1       0.255  -2.352   0.632  1.00  0.00           O  
HETATM   15  O   UNL     1       4.293  -0.619  -0.159  1.00  0.00           O  
HETATM   16  OXT UNL     1       4.024   1.548   0.178  1.00  0.00           O  
HETATM   17  O   UNL     1      -2.173   2.684  -0.087  1.00  0.00           O  
HETATM   18  H   UNL     1      -2.036  -2.762   0.090  1.00  0.00           H  
HETATM   19  H   UNL     1      -4.098   1.816  -0.526  1.00  0.00           H  
HETATM   20  H   UNL     1      -0.072   2.784   0.414  1.00  0.00           H  
HETATM   21  H   UNL     1       1.665  -0.692   1.447  1.00  0.00           H  
HETATM   22  H   UNL     1       1.334   1.053   1.322  1.00  0.00           H  
HETATM   23  HA  UNL     1       1.758   1.002  -1.088  1.00  0.00           H  
HETATM   24  H1  UNL     1       2.218  -1.884  -0.703  1.00  0.00           H  
HETATM   25  H2  UNL     1       0.956  -1.195  -1.538  1.00  0.00           H  
HETATM   26  HXT UNL     1       4.965   1.610   0.390  1.00  0.00           H  
CONECT    1   14   14   11    3                                       
CONECT    2   11    7    7    5                                       
CONECT    3    1    6   18                                            
CONECT    4   17    5    5   19                                       
CONECT    5    2    4    4    6                                       
CONECT    6    3    5   13   13                                       
CONECT    7    2    2   17   20                                       
CONECT    8    9   11   21   22                                       
CONECT    9   10   12    8   23                                       
CONECT   10   15   15   16    9                                       
CONECT   11    8    1    2                                            
CONECT   12    9   24   25                                            
CONECT   13    6    6                                                 
CONECT   14    1    1                                                 
CONECT   15   10   10                                                 
CONECT   16   10   26                                                 
CONECT   17    7    4                                                 
CONECT   18    3                                                      
CONECT   19    4                                                      
CONECT   20    7                                                      
CONECT   21    8                                                      
CONECT   22    8                                                      
CONECT   23    9                                                      
CONECT   24   12                                                      
CONECT   25   12                                                      
CONECT   26   16                                                      
MASTER        0    0    0    0    0    0    0    0   26    0   26    0
END
