COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.489   0.853   0.528  1.00  0.00           C  
HETATM    2  O   UNL     1      -3.390   0.233   1.038  1.00  0.00           O  
HETATM    3  C   UNL     1      -1.404   0.126  -0.223  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.051   0.411   0.431  1.00  0.00           C  
HETATM    5  CA  UNL     1       1.066  -0.202  -0.417  1.00  0.00           C  
HETATM    6  N   UNL     1       0.942  -1.666  -0.405  1.00  0.00           N  
HETATM    7  O   UNL     1       3.018  -0.580   0.847  1.00  0.00           O  
HETATM    8  C   UNL     1       2.404   0.194   0.152  1.00  0.00           C  
HETATM    9  OXT UNL     1       2.913   1.407  -0.113  1.00  0.00           O  
HETATM   10  H   UNL     1      -2.463   1.930   0.606  1.00  0.00           H  
HETATM   11  O   UNL     1      -1.662  -1.280  -0.191  1.00  0.00           O  
HETATM   12  O   UNL     1      -1.380   0.574  -1.580  1.00  0.00           O  
HETATM   13  H   UNL     1       0.098   1.488   0.504  1.00  0.00           H  
HETATM   14  H   UNL     1      -0.031  -0.027   1.429  1.00  0.00           H  
HETATM   15  HA  UNL     1       0.984   0.161  -1.441  1.00  0.00           H  
HETATM   16  H1  UNL     1       0.889  -2.016   0.540  1.00  0.00           H  
HETATM   17  H2  UNL     1       0.147  -1.966  -0.948  1.00  0.00           H  
HETATM   18  HXT UNL     1       3.775   1.616   0.274  1.00  0.00           H  
HETATM   19  H   UNL     1      -1.692  -1.653   0.701  1.00  0.00           H  
HETATM   20  H   UNL     1      -1.210   1.521  -1.678  1.00  0.00           H  
CONECT    1    2    2   10    3                                       
CONECT    2    1    1                                                 
CONECT    3    1   11   12    4                                       
CONECT    4    3   13   14    5                                       
CONECT    5    4   15    6    8                                       
CONECT    6    5   16   17                                            
CONECT    7    8    8                                                 
CONECT    8    7    7    5    9                                       
CONECT    9    8   18                                                 
CONECT   10    1                                                      
CONECT   11    3   19                                                 
CONECT   12    3   20                                                 
CONECT   13    4                                                      
CONECT   14    4                                                      
CONECT   15    5                                                      
CONECT   16    6                                                      
CONECT   17    6                                                      
CONECT   18    9                                                      
CONECT   19   11                                                      
CONECT   20   12                                                      
MASTER        0    0    0    0    0    0    0    0   20    0   20    0
END
