COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.283  -0.023   0.196  1.00  0.00           C  
HETATM    2  O   UNL     1       5.969   0.014  -0.798  1.00  0.00           O  
HETATM    3  CA  UNL     1       3.939   0.659   0.210  1.00  0.00           C  
HETATM    4  N   UNL     1       3.893   1.671  -0.854  1.00  0.00           N  
HETATM    5  C   UNL     1       2.839  -0.377  -0.023  1.00  0.00           C  
HETATM    6  C   UNL     1       1.470   0.292   0.115  1.00  0.00           C  
HETATM    7  C   UNL     1       0.369  -0.744  -0.118  1.00  0.00           C  
HETATM    8  N   UNL     1      -0.942  -0.103   0.014  1.00  0.00           N  
HETATM    9  C   UNL     1      -2.066  -0.828  -0.151  1.00  0.00           C  
HETATM   10  O   UNL     1      -1.993  -2.013  -0.409  1.00  0.00           O  
HETATM   11  C   UNL     1      -3.391  -0.179  -0.017  1.00  0.00           C  
HETATM   12  N   UNL     1      -3.474   1.119   0.260  1.00  0.00           N  
HETATM   13  C   UNL     1      -4.654   1.693   0.378  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.811   0.945   0.213  1.00  0.00           C  
HETATM   15  N   UNL     1      -5.735  -0.345  -0.062  1.00  0.00           N  
HETATM   16  C   UNL     1      -4.556  -0.927  -0.187  1.00  0.00           C  
HETATM   17  HA  UNL     1       3.786   1.141   1.176  1.00  0.00           H  
HETATM   18  H1  UNL     1       4.568   2.402  -0.688  1.00  0.00           H  
HETATM   19  H   UNL     1       2.939  -0.796  -1.025  1.00  0.00           H  
HETATM   20  H   UNL     1       2.929  -1.175   0.714  1.00  0.00           H  
HETATM   21  H   UNL     1       1.369   0.710   1.117  1.00  0.00           H  
HETATM   22  H   UNL     1       1.380   1.090  -0.623  1.00  0.00           H  
HETATM   23  H   UNL     1       0.470  -1.163  -1.120  1.00  0.00           H  
HETATM   24  H   UNL     1       0.459  -1.542   0.619  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.000   0.843   0.220  1.00  0.00           H  
HETATM   26  H   UNL     1      -4.721   2.747   0.603  1.00  0.00           H  
HETATM   27  H   UNL     1      -6.777   1.418   0.311  1.00  0.00           H  
HETATM   28  H   UNL     1      -4.494  -1.980  -0.417  1.00  0.00           H  
HETATM   29  H2  UNL     1       4.032   1.249  -1.760  1.00  0.00           H  
HETATM   30  OXT UNL     1       5.715  -0.677   1.285  1.00  0.00           O  
HETATM   31  HXT UNL     1       6.583  -1.099   1.229  1.00  0.00           H  
CONECT    1    2    2    3   30                                       
CONECT    2    1    1                                                 
CONECT    3    4    1    5   17                                       
CONECT    4    3   18   29                                            
CONECT    5    3    6   19   20                                       
CONECT    6    5    7   21   22                                       
CONECT    7    6    8   23   24                                       
CONECT    8    7    9   25                                            
CONECT    9    8   11   10   10                                       
CONECT   10    9    9                                                 
CONECT   11   12    9   16   16                                       
CONECT   12   13   13   11                                            
CONECT   13   12   12   14   26                                       
CONECT   14   13   15   15   27                                       
CONECT   15   14   14   16                                            
CONECT   16   11   11   15   28                                       
CONECT   17    3                                                      
CONECT   18    4                                                      
CONECT   19    5                                                      
CONECT   20    5                                                      
CONECT   21    6                                                      
CONECT   22    6                                                      
CONECT   23    7                                                      
CONECT   24    7                                                      
CONECT   25    8                                                      
CONECT   26   13                                                      
CONECT   27   14                                                      
CONECT   28   16                                                      
CONECT   29    4                                                      
CONECT   30    1   31                                                 
CONECT   31   30                                                      
MASTER        0    0    0    0    0    0    0    0   31    0   31    0
END
