COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       0.081   0.695   2.496  1.00  0.00           N  
HETATM    2  CA  UNL     1       0.428  -0.661   2.019  1.00  0.00           C  
HETATM    3  C   UNL     1       1.933  -0.762   2.000  1.00  0.00           C  
HETATM    4  O   UNL     1       2.659  -0.534   1.043  1.00  0.00           O  
HETATM    5  OXT UNL     1       2.401  -1.129   3.221  1.00  0.00           O  
HETATM    6  C   UNL     1      -0.168  -0.874   0.639  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.563  -1.365   0.515  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.443  -0.919  -0.578  1.00  0.00           C  
HETATM    9  O   UNL     1      -2.078  -0.673  -1.718  1.00  0.00           O  
HETATM   10  O   UNL     1      -3.724  -0.812  -0.148  1.00  0.00           O  
HETATM   11  C   UNL     1      -0.409  -2.270   0.195  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.077  -3.361   1.127  1.00  0.00           C  
HETATM   13  O   UNL     1       1.230  -3.702   1.018  1.00  0.00           O  
HETATM   14  O   UNL     1      -0.864  -3.889   1.898  1.00  0.00           O  
HETATM   15  H1  UNL     1      -0.495   0.757   3.297  1.00  0.00           H  
HETATM   16  H2  UNL     1       0.265   1.449   1.884  1.00  0.00           H  
HETATM   17  HA  UNL     1       0.034  -1.384   2.741  1.00  0.00           H  
HETATM   18  HXT UNL     1       3.380  -1.186   3.235  1.00  0.00           H  
HETATM   19  H   UNL     1       0.204  -0.135  -0.040  1.00  0.00           H  
HETATM   20  H   UNL     1      -2.083  -1.529   1.453  1.00  0.00           H  
HETATM   21  H   UNL     1      -4.327  -0.514  -0.862  1.00  0.00           H  
HETATM   22  H   UNL     1      -0.243  -2.516  -0.849  1.00  0.00           H  
HETATM   23  H   UNL     1       1.472  -4.427   1.633  1.00  0.00           H  
CONECT    1    2   15   16                                            
CONECT    2    6    1    3   17                                       
CONECT    3    2    4    4    5                                       
CONECT    4    3    3                                                 
CONECT    5    3   18                                                 
CONECT    6    7   11    2   19                                       
CONECT    7    8   11    6   20                                       
CONECT    8    9    9    7   10                                       
CONECT    9    8    8                                                 
CONECT   10    8   21                                                 
CONECT   11    7   12    6   22                                       
CONECT   12   14   14   11   13                                       
CONECT   13   12   23                                                 
CONECT   14   12   12                                                 
CONECT   15    1                                                      
CONECT   16    1                                                      
CONECT   17    2                                                      
CONECT   18    5                                                      
CONECT   19    6                                                      
CONECT   20    7                                                      
CONECT   21   10                                                      
CONECT   22   11                                                      
CONECT   23   13                                                      
MASTER        0    0    0    0    0    0    0    0   23    0   23    0
END
