COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.892  -0.493   0.002  1.00  0.00           C  
HETATM    2  OXT UNL     1      -3.331  -1.199   0.001  1.00  0.00           O  
HETATM    3  C   UNL     1      -2.728   0.008   0.000  1.00  0.00           C  
HETATM    4  O   UNL     1      -3.398   1.023  -0.002  1.00  0.00           O  
HETATM    5  CA  UNL     1      -1.267   0.096   0.000  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.540   1.248  -0.001  1.00  0.00           C  
HETATM    7  C   UNL     1       0.835   0.888   0.001  1.00  0.00           C  
HETATM    8  C   UNL     1       2.160   1.493   0.001  1.00  0.00           C  
HETATM    9  C   UNL     1       3.157   0.632   0.002  1.00  0.00           C  
HETATM   10  S   UNL     1       2.571  -1.020  -0.002  1.00  0.00           S  
HETATM   11  N   UNL     1      -0.395  -0.975   0.002  1.00  0.00           N  
HETATM   12  HXT UNL     1      -4.297  -1.156   0.001  1.00  0.00           H  
HETATM   13  H   UNL     1      -0.936   2.252  -0.003  1.00  0.00           H  
HETATM   14  H   UNL     1       2.312   2.562  -0.001  1.00  0.00           H  
HETATM   15  H   UNL     1       4.201   0.909   0.003  1.00  0.00           H  
HETATM   16  H   UNL     1      -0.648  -1.912   0.002  1.00  0.00           H  
CONECT    1   10    7    7   11                                       
CONECT    2    3   12                                                 
CONECT    3    5    4    4    2                                       
CONECT    4    3    3                                                 
CONECT    5    6    6   11    3                                       
CONECT    6    7    5    5   13                                       
CONECT    7    8    1    1    6                                       
CONECT    8    9    9    7   14                                       
CONECT    9    8    8   10   15                                       
CONECT   10    9    1                                                 
CONECT   11    1    5   16                                            
CONECT   12    2                                                      
CONECT   13    6                                                      
CONECT   14    8                                                      
CONECT   15    9                                                      
CONECT   16   11                                                      
MASTER        0    0    0    0    0    0    0    0   16    0   16    0
END
