COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       1.814   0.239   0.817  1.00  0.00           N  
HETATM    2  CA  UNL     1       0.374   0.527   0.821  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.275  -0.101  -0.412  1.00  0.00           C  
HETATM    4  C   UNL     1       0.357   0.485  -1.676  1.00  0.00           C  
HETATM    5  S   UNL     1      -0.412  -0.259  -3.140  1.00  0.00           S  
HETATM    6  C   UNL     1      -0.249  -0.050   2.066  1.00  0.00           C  
HETATM    7  O   UNL     1      -1.326   0.536   2.611  1.00  0.00           O  
HETATM    8  OXT UNL     1       0.219  -1.041   2.573  1.00  0.00           O  
HETATM    9  H1  UNL     1       1.909  -0.765   0.833  1.00  0.00           H  
HETATM   10  H2  UNL     1       2.169   0.549  -0.074  1.00  0.00           H  
HETATM   11  HA  UNL     1       0.219   1.605   0.804  1.00  0.00           H  
HETATM   12  H   UNL     1      -0.120  -1.179  -0.395  1.00  0.00           H  
HETATM   13  H   UNL     1      -1.344   0.112  -0.409  1.00  0.00           H  
HETATM   14  H   UNL     1       0.202   1.564  -1.693  1.00  0.00           H  
HETATM   15  H   UNL     1       1.426   0.271  -1.679  1.00  0.00           H  
HETATM   16  H   UNL     1       0.268   0.375  -4.110  1.00  0.00           H  
HETATM   17  H   UNL     1      -1.726   0.165   3.410  1.00  0.00           H  
CONECT    1    2    9   10                                            
CONECT    2    1    3    6   11                                       
CONECT    3    2    4   12   13                                       
CONECT    4    3    5   14   15                                       
CONECT    5    4   16                                                 
CONECT    6    2    7    8    8                                       
CONECT    7    6   17                                                 
CONECT    8    6    6                                                 
CONECT    9    1                                                      
CONECT   10    1                                                      
CONECT   11    2                                                      
CONECT   12    3                                                      
CONECT   13    3                                                      
CONECT   14    4                                                      
CONECT   15    4                                                      
CONECT   16    5                                                      
CONECT   17    7                                                      
MASTER        0    0    0    0    0    0    0    0   17    0   17    0
END
