COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       1.326   0.899   1.589  1.00  0.00           N  
HETATM    2  CA  UNL     1       1.257  -0.141   0.554  1.00  0.00           C  
HETATM    3  C   UNL     1       2.487  -0.069  -0.314  1.00  0.00           C  
HETATM    4  C   UNL     1       0.011   0.079  -0.307  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.242  -0.117   0.549  1.00  0.00           C  
HETATM    6  O   UNL     1      -1.316  -1.478   0.979  1.00  0.00           O  
HETATM    7  C   UNL     1      -2.464   0.219  -0.266  1.00  0.00           C  
HETATM    8  O   UNL     1      -2.661   1.476  -0.693  1.00  0.00           O  
HETATM    9  O   UNL     1      -3.267  -0.643  -0.534  1.00  0.00           O  
HETATM   10  O   UNL     1       3.145   0.944  -0.345  1.00  0.00           O  
HETATM   11  OXT UNL     1       2.850  -1.129  -1.052  1.00  0.00           O  
HETATM   12  H1  UNL     1       1.377   1.818   1.176  1.00  0.00           H  
HETATM   13  H2  UNL     1       0.545   0.830   2.224  1.00  0.00           H  
HETATM   14  HA  UNL     1       1.203  -1.122   1.027  1.00  0.00           H  
HETATM   15  H   UNL     1       0.022   1.093  -0.709  1.00  0.00           H  
HETATM   16  H   UNL     1       0.006  -0.637  -1.129  1.00  0.00           H  
HETATM   17  H   UNL     1      -1.194   0.538   1.419  1.00  0.00           H  
HETATM   18  H   UNL     1      -1.361  -2.117   0.256  1.00  0.00           H  
HETATM   19  H   UNL     1      -3.459   1.644  -1.212  1.00  0.00           H  
HETATM   20  HXT UNL     1       3.647  -1.035  -1.593  1.00  0.00           H  
CONECT    1    2   12   13                                            
CONECT    2    1    3    4   14                                       
CONECT    3    2   10   10   11                                       
CONECT    4    2    5   15   16                                       
CONECT    5    4    6    7   17                                       
CONECT    6    5   18                                                 
CONECT    7    5    8    9    9                                       
CONECT    8    7   19                                                 
CONECT    9    7    7                                                 
CONECT   10    3    3                                                 
CONECT   11    3   20                                                 
CONECT   12    1                                                      
CONECT   13    1                                                      
CONECT   14    2                                                      
CONECT   15    4                                                      
CONECT   16    4                                                      
CONECT   17    5                                                      
CONECT   18    6                                                      
CONECT   19    8                                                      
CONECT   20   11                                                      
MASTER        0    0    0    0    0    0    0    0   20    0   20    0
END
