COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.341   0.521   0.534  1.00  0.00           C  
HETATM    2  C   UNL     1       1.220   0.932  -0.005  1.00  0.00           C  
HETATM    3  CA  UNL     1       0.275  -0.061  -0.630  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.090   0.084  -0.008  1.00  0.00           C  
HETATM    5  O   UNL     1      -1.793   1.120  -0.247  1.00  0.00           O1-
HETATM    6  OXT UNL     1      -1.542  -0.831   0.758  1.00  0.00           O  
HETATM    7  N   UNL     1       0.775  -1.423  -0.402  1.00  0.00           N1+
HETATM    8  H   UNL     1       2.587  -0.531   0.531  1.00  0.00           H  
HETATM    9  H   UNL     1       3.018   1.233   0.982  1.00  0.00           H  
HETATM   10  H   UNL     1       0.973   1.984  -0.002  1.00  0.00           H  
HETATM   11  HA  UNL     1       0.207   0.126  -1.702  1.00  0.00           H  
HETATM   12  H1  UNL     1       0.838  -1.597   0.590  1.00  0.00           H  
HETATM   13  H2  UNL     1       1.689  -1.520  -0.818  1.00  0.00           H  
HETATM   14  H3  UNL     1       0.142  -2.089  -0.820  1.00  0.00           H  
CONECT    1    2    2    8    9                                       
CONECT    2    1    1    3   10                                       
CONECT    3    2    4    7   11                                       
CONECT    4    3    5    6    6                                       
CONECT    5    4                                                      
CONECT    6    4    4                                                 
CONECT    7    3   12   13   14                                       
CONECT    8    1                                                      
CONECT    9    1                                                      
CONECT   10    2                                                      
CONECT   11    3                                                      
CONECT   12    7                                                      
CONECT   13    7                                                      
CONECT   14    7                                                      
MASTER        0    0    0    0    0    0    0    0   14    0   14    0
END
