COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -1.275   1.771  -0.253  1.00  0.00           N  
HETATM    2  CA  UNL     1      -1.310   0.320  -0.478  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.180  -0.345   0.310  1.00  0.00           C  
HETATM    4  C   UNL     1       1.169   0.118  -0.245  1.00  0.00           C  
HETATM    5  C   UNL     1       2.300  -0.548   0.543  1.00  0.00           C  
HETATM    6  S   UNL     1       3.899   0.002  -0.115  1.00  0.00           S  
HETATM    7  C   UNL     1      -2.635  -0.229  -0.014  1.00  0.00           C  
HETATM    8  O   UNL     1      -3.311   0.402   0.764  1.00  0.00           O  
HETATM    9  OXT UNL     1      -3.065  -1.417  -0.467  1.00  0.00           O  
HETATM   10  H1  UNL     1      -1.972   2.240  -0.813  1.00  0.00           H  
HETATM   11  H2  UNL     1      -1.391   1.988   0.725  1.00  0.00           H  
HETATM   12  HA  UNL     1      -1.183   0.113  -1.541  1.00  0.00           H  
HETATM   13  H   UNL     1      -0.256  -0.066   1.361  1.00  0.00           H  
HETATM   14  H   UNL     1      -0.259  -1.428   0.215  1.00  0.00           H  
HETATM   15  H   UNL     1       1.245  -0.162  -1.296  1.00  0.00           H  
HETATM   16  H   UNL     1       1.248   1.201  -0.150  1.00  0.00           H  
HETATM   17  H   UNL     1       2.224  -0.268   1.594  1.00  0.00           H  
HETATM   18  H   UNL     1       2.220  -1.630   0.448  1.00  0.00           H  
HETATM   19  H   UNL     1       4.784  -0.651   0.659  1.00  0.00           H  
HETATM   20  HXT UNL     1      -3.921  -1.727  -0.141  1.00  0.00           H  
CONECT    1    2   10   11                                            
CONECT    2    1    7    3   12                                       
CONECT    3    2    4   13   14                                       
CONECT    4    5    3   15   16                                       
CONECT    5    6    4   17   18                                       
CONECT    6    5   19                                                 
CONECT    7    2    8    8    9                                       
CONECT    8    7    7                                                 
CONECT    9    7   20                                                 
CONECT   10    1                                                      
CONECT   11    1                                                      
CONECT   12    2                                                      
CONECT   13    3                                                      
CONECT   14    3                                                      
CONECT   15    4                                                      
CONECT   16    4                                                      
CONECT   17    5                                                      
CONECT   18    5                                                      
CONECT   19    6                                                      
CONECT   20    9                                                      
MASTER        0    0    0    0    0    0    0    0   20    0   20    0
END
