COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.380   0.231   0.006  1.00  0.00           C  
HETATM    2  O   UNL     1       2.965  -0.320   0.908  1.00  0.00           O  
HETATM    3  CA  UNL     1       1.120  -0.375  -0.557  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.097   0.333   0.041  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.371  -0.195  -0.622  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.588   0.513  -0.025  1.00  0.00           C  
HETATM    7  N   UNL     1      -3.811   0.005  -0.661  1.00  0.00           N  
HETATM    8  N   UNL     1      -2.645   0.254   1.420  1.00  0.00           N  
HETATM    9  N   UNL     1       1.071  -1.803  -0.219  1.00  0.00           N  
HETATM   10  HA  UNL     1       1.113  -0.257  -1.641  1.00  0.00           H  
HETATM   11  H   UNL     1      -0.139   0.142   1.113  1.00  0.00           H  
HETATM   12  H   UNL     1      -0.015   1.406  -0.134  1.00  0.00           H  
HETATM   13  H   UNL     1      -1.329  -0.004  -1.694  1.00  0.00           H  
HETATM   14  H   UNL     1      -1.452  -1.268  -0.448  1.00  0.00           H  
HETATM   15  H   UNL     1      -2.507   1.586  -0.199  1.00  0.00           H  
HETATM   16  H   UNL     1      -3.877  -0.998  -0.569  1.00  0.00           H  
HETATM   17  H   UNL     1      -4.630   0.457  -0.283  1.00  0.00           H  
HETATM   18  H   UNL     1      -2.721  -0.734   1.608  1.00  0.00           H  
HETATM   19  H   UNL     1      -1.845   0.651   1.890  1.00  0.00           H  
HETATM   20  H1  UNL     1       1.830  -2.305  -0.656  1.00  0.00           H  
HETATM   21  OXT UNL     1       2.850   1.387  -0.491  1.00  0.00           O  
HETATM   22  HXT UNL     1       3.661   1.736  -0.098  1.00  0.00           H  
HETATM   23  H2  UNL     1       1.076  -1.939   0.781  1.00  0.00           H  
CONECT    1    2    2    3   21                                       
CONECT    2    1    1                                                 
CONECT    3    1    4    9   10                                       
CONECT    4    3    5   11   12                                       
CONECT    5    6    4   13   14                                       
CONECT    6    8    7    5   15                                       
CONECT    7    6   16   17                                            
CONECT    8    6   18   19                                            
CONECT    9    3   20   23                                            
CONECT   10    3                                                      
CONECT   11    4                                                      
CONECT   12    4                                                      
CONECT   13    5                                                      
CONECT   14    5                                                      
CONECT   15    6                                                      
CONECT   16    7                                                      
CONECT   17    7                                                      
CONECT   18    8                                                      
CONECT   19    8                                                      
CONECT   20    9                                                      
CONECT   21    1   22                                                 
CONECT   22   21                                                      
CONECT   23    9                                                      
MASTER        0    0    0    0    0    0    0    0   23    0   23    0
END
