COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.320   1.888   0.006  1.00  0.00           C  
HETATM    2  O   UNL     1      -1.019  -1.714  -0.443  1.00  0.00           O  
HETATM    3  N   UNL     1       2.170  -0.436   0.324  1.00  0.00           N  
HETATM    4  C   UNL     1       1.010   1.928  -0.442  1.00  0.00           C  
HETATM    5  C   UNL     1       0.293   0.743  -0.496  1.00  0.00           C  
HETATM    6  CA  UNL     1       0.911  -0.441  -0.100  1.00  0.00           C  
HETATM    7  C   UNL     1       2.872   0.674   0.386  1.00  0.00           C  
HETATM    8  C   UNL     1       0.159  -1.715  -0.151  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.135   0.734  -0.977  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.064   0.677   0.209  1.00  0.00           C  
HETATM   11  OXT UNL     1       0.783  -2.877   0.125  1.00  0.00           O  
HETATM   12  O   UNL     1      -1.612   0.645   1.329  1.00  0.00           O  
HETATM   13  O   UNL     1      -3.393   0.660   0.020  1.00  0.00           O  
HETATM   14  H   UNL     1       2.907   2.793   0.056  1.00  0.00           H  
HETATM   15  H   UNL     1       0.557   2.861  -0.743  1.00  0.00           H  
HETATM   16  H   UNL     1       3.894   0.639   0.732  1.00  0.00           H  
HETATM   17  H   UNL     1      -1.332   1.642  -1.548  1.00  0.00           H  
HETATM   18  H   UNL     1      -1.301  -0.137  -1.611  1.00  0.00           H  
HETATM   19  HXT UNL     1       0.250  -3.683   0.079  1.00  0.00           H  
HETATM   20  H   UNL     1      -3.948   0.623   0.811  1.00  0.00           H  
CONECT    1    4    4    7   14                                       
CONECT    2    8    8                                                 
CONECT    3    6    7    7                                            
CONECT    4    5    1    1   15                                       
CONECT    5    9    6    6    4                                       
CONECT    6    8    5    5    3                                       
CONECT    7    3    3    1   16                                       
CONECT    8    2    2   11    6                                       
CONECT    9   10    5   17   18                                       
CONECT   10   12   12    9   13                                       
CONECT   11    8   19                                                 
CONECT   12   10   10                                                 
CONECT   13   10   20                                                 
CONECT   14    1                                                      
CONECT   15    4                                                      
CONECT   16    7                                                      
CONECT   17    9                                                      
CONECT   18    9                                                      
CONECT   19   11                                                      
CONECT   20   13                                                      
MASTER        0    0    0    0    0    0    0    0   20    0   20    0
END
