COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -0.812   2.218  -0.352  1.00  0.00           N  
HETATM    2  CA  UNL     1      -0.816   0.756  -0.485  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.093   0.202   0.093  1.00  0.00           C  
HETATM    4  O   UNL     1      -2.739   0.862   0.873  1.00  0.00           O  
HETATM    5  C   UNL     1       3.174   0.254   0.771  1.00  0.00           C  
HETATM    6  S   UNL     1       1.908   0.948  -0.327  1.00  0.00           S  
HETATM    7  C   UNL     1       0.380   0.172   0.269  1.00  0.00           C  
HETATM    8  C   UNL     1       0.447  -1.315   0.032  1.00  0.00           C  
HETATM    9  O   UNL     1       0.384  -1.798  -1.219  1.00  0.00           O  
HETATM   10  O   UNL     1       0.557  -2.072   0.967  1.00  0.00           O  
HETATM   11  H1  UNL     1      -0.875   2.494   0.617  1.00  0.00           H  
HETATM   12  H2  UNL     1       0.004   2.619  -0.790  1.00  0.00           H  
HETATM   13  HA  UNL     1      -0.748   0.486  -1.539  1.00  0.00           H  
HETATM   14  H   UNL     1       0.267   0.365   1.336  1.00  0.00           H  
HETATM   15  H   UNL     1       0.431  -2.759  -1.321  1.00  0.00           H  
HETATM   16  OXT UNL     1      -2.513  -1.024  -0.258  1.00  0.00           O  
HETATM   17  H   UNL     1       2.944   0.518   1.804  1.00  0.00           H  
HETATM   18  H   UNL     1       3.188  -0.831   0.669  1.00  0.00           H  
HETATM   19  H   UNL     1       4.150   0.657   0.501  1.00  0.00           H  
HETATM   20  HXT UNL     1      -3.337  -1.336   0.139  1.00  0.00           H  
CONECT    1    2   11   12                                            
CONECT    2    3    1    7   13                                       
CONECT    3    4    4    2   16                                       
CONECT    4    3    3                                                 
CONECT    5    6   17   18   19                                       
CONECT    6    5    7                                                 
CONECT    7    2    6    8   14                                       
CONECT    8    7   10   10    9                                       
CONECT    9    8   15                                                 
CONECT   10    8    8                                                 
CONECT   11    1                                                      
CONECT   12    1                                                      
CONECT   13    2                                                      
CONECT   14    7                                                      
CONECT   15    9                                                      
CONECT   16    3   20                                                 
CONECT   17    5                                                      
CONECT   18    5                                                      
CONECT   19    5                                                      
CONECT   20   16                                                      
MASTER        0    0    0    0    0    0    0    0   20    0   20    0
END
