COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.712  -1.663   0.096  1.00  0.00           C  
HETATM    2  C   UNL     1       2.401   0.256  -0.001  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.734   1.038  -0.102  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.276   0.792  -0.069  1.00  0.00           C  
HETATM    5  C   UNL     1       1.983   1.573  -0.097  1.00  0.00           C  
HETATM    6  C   UNL     1       0.627   1.857  -0.132  1.00  0.00           C  
HETATM    7  O   UNL     1      -2.297   1.873   0.793  1.00  0.00           O  
HETATM    8  O   UNL     1      -2.424   0.488  -0.936  1.00  0.00           O  
HETATM    9  CA  UNL     1       0.226  -0.517   0.028  1.00  0.00           C  
HETATM   10  O   UNL     1      -1.907  -1.465   0.175  1.00  0.00           O  
HETATM   11  OXT UNL     1      -0.238  -2.923   0.065  1.00  0.00           O  
HETATM   12  N   UNL     1       1.533  -0.733   0.057  1.00  0.00           N  
HETATM   13  C   UNL     1       3.875  -0.052   0.030  1.00  0.00           C  
HETATM   14  H   UNL     1       2.708   2.372  -0.143  1.00  0.00           H  
HETATM   15  H   UNL     1       0.277   2.876  -0.207  1.00  0.00           H  
HETATM   16  H   UNL     1      -3.253   2.003   0.732  1.00  0.00           H  
HETATM   17  HXT UNL     1      -0.888  -3.638   0.113  1.00  0.00           H  
HETATM   18  H   UNL     1       4.224  -0.054   1.063  1.00  0.00           H  
HETATM   19  H   UNL     1       4.052  -1.031  -0.415  1.00  0.00           H  
HETATM   20  H   UNL     1       4.417   0.706  -0.535  1.00  0.00           H  
CONECT    1   10   10   11    9                                       
CONECT    2   12   13    5    5                                       
CONECT    3    8    8    4    7                                       
CONECT    4    9    3    6    6                                       
CONECT    5    2    2    6   14                                       
CONECT    6    4    4    5   15                                       
CONECT    7    3   16                                                 
CONECT    8    3    3                                                 
CONECT    9    1   12   12    4                                       
CONECT   10    1    1                                                 
CONECT   11    1   17                                                 
CONECT   12    9    9    2                                            
CONECT   13    2   18   19   20                                       
CONECT   14    5                                                      
CONECT   15    6                                                      
CONECT   16    7                                                      
CONECT   17   11                                                      
CONECT   18   13                                                      
CONECT   19   13                                                      
CONECT   20   13                                                      
MASTER        0    0    0    0    0    0    0    0   20    0   20    0
END
