COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -0.561   1.921   2.722  1.00  0.00           N  
HETATM    2  CA  UNL     1      -0.790   1.935   1.273  1.00  0.00           C  
HETATM    3  C   UNL     1       0.151   0.934   0.583  1.00  0.00           C  
HETATM    4  C   UNL     1       1.661   1.158   0.785  1.00  0.00           C  
HETATM    5  C   UNL     1       2.511  -0.017   0.316  1.00  0.00           C  
HETATM    6  C   UNL     1       2.110   2.472   0.173  1.00  0.00           C  
HETATM    7  O   UNL     1       1.387   3.219  -0.479  1.00  0.00           O  
HETATM    8  C   UNL     1      -2.250   1.567   1.083  1.00  0.00           C  
HETATM    9  O   UNL     1      -3.009   1.240   1.987  1.00  0.00           O  
HETATM   10  OXT UNL     1      -2.638   1.617  -0.217  1.00  0.00           O  
HETATM   11  H1  UNL     1      -1.338   2.100   3.315  1.00  0.00           H  
HETATM   12  H2  UNL     1       0.380   1.938   3.041  1.00  0.00           H  
HETATM   13  HA  UNL     1      -0.605   2.958   0.933  1.00  0.00           H  
HETATM   14  H   UNL     1      -0.061   0.916  -0.495  1.00  0.00           H  
HETATM   15  H   UNL     1      -0.080  -0.074   0.955  1.00  0.00           H  
HETATM   16  H   UNL     1       1.827   1.279   1.864  1.00  0.00           H  
HETATM   17  H   UNL     1       3.110  -0.421   1.139  1.00  0.00           H  
HETATM   18  H   UNL     1       1.873  -0.825  -0.060  1.00  0.00           H  
HETATM   19  H   UNL     1       3.186   0.262  -0.499  1.00  0.00           H  
HETATM   20  H   UNL     1       3.154   2.761   0.389  1.00  0.00           H  
HETATM   21  HXT UNL     1      -3.571   1.373  -0.393  1.00  0.00           H  
CONECT    1    2   11   12                                            
CONECT    2    1    3    8   13                                       
CONECT    3    2    4   14   15                                       
CONECT    4    3    5    6   16                                       
CONECT    5    4   17   18   19                                       
CONECT    6    4    7    7   20                                       
CONECT    7    6    6                                                 
CONECT    8    2    9    9   10                                       
CONECT    9    8    8                                                 
CONECT   10    8   21                                                 
CONECT   11    1                                                      
CONECT   12    1                                                      
CONECT   13    2                                                      
CONECT   14    3                                                      
CONECT   15    3                                                      
CONECT   16    4                                                      
CONECT   17    5                                                      
CONECT   18    5                                                      
CONECT   19    5                                                      
CONECT   20    6                                                      
CONECT   21   10                                                      
MASTER        0    0    0    0    0    0    0    0   21    0   21    0
END
