COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       1.408   0.924   1.154  1.00  0.00           N  
HETATM    2  CA  UNL     1       0.047   0.410   1.357  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.138   0.038   2.805  1.00  0.00           C  
HETATM    4  O   UNL     1       0.805  -0.338   3.458  1.00  0.00           O  
HETATM    5  OXT UNL     1      -1.352   0.125   3.370  1.00  0.00           O  
HETATM    6  C   UNL     1      -0.166  -0.825   0.481  1.00  0.00           C  
HETATM    7  C   UNL     1       0.019  -0.453  -0.967  1.00  0.00           C  
HETATM    8  C   UNL     1       1.151  -0.466  -1.713  1.00  0.00           C  
HETATM    9  C   UNL     1       1.084  -0.082  -3.039  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.109   0.305  -3.551  1.00  0.00           C  
HETATM   11  S   UNL     1      -1.191   0.126  -2.143  1.00  0.00           S  
HETATM   12  H1  UNL     1       1.522   1.062   0.161  1.00  0.00           H  
HETATM   13  H2  UNL     1       2.040   0.183   1.418  1.00  0.00           H  
HETATM   14  HA  UNL     1      -0.675   1.179   1.083  1.00  0.00           H  
HETATM   15  HXT UNL     1      -1.472  -0.113   4.299  1.00  0.00           H  
HETATM   16  H   UNL     1       0.556  -1.594   0.754  1.00  0.00           H  
HETATM   17  H   UNL     1      -1.176  -1.206   0.631  1.00  0.00           H  
HETATM   18  H   UNL     1       2.089  -0.779  -1.280  1.00  0.00           H  
HETATM   19  H   UNL     1       1.969  -0.088  -3.657  1.00  0.00           H  
HETATM   20  H   UNL     1      -0.344   0.636  -4.552  1.00  0.00           H  
CONECT    1    2   12   13                                            
CONECT    2    1    3    6   14                                       
CONECT    3    2    4    4    5                                       
CONECT    4    3    3                                                 
CONECT    5    3   15                                                 
CONECT    6    2    7   16   17                                       
CONECT    7    6    8    8   11                                       
CONECT    8    7    7    9   18                                       
CONECT    9    8   10   10   19                                       
CONECT   10    9    9   11   20                                       
CONECT   11    7   10                                                 
CONECT   12    1                                                      
CONECT   13    1                                                      
CONECT   14    2                                                      
CONECT   15    5                                                      
CONECT   16    6                                                      
CONECT   17    6                                                      
CONECT   18    8                                                      
CONECT   19    9                                                      
CONECT   20   10                                                      
MASTER        0    0    0    0    0    0    0    0   20    0   20    0
END
