COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.595   0.156   0.059  1.00  0.00           C  
HETATM    2  O   UNL     1       4.296  -0.790  -0.213  1.00  0.00           O  
HETATM    3  CA  UNL     1       2.145  -0.056   0.408  1.00  0.00           C  
HETATM    4  C   UNL     1       1.275   0.260  -0.810  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.179   0.167  -0.427  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.842   1.283   0.046  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.177   1.198   0.398  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.848  -0.004   0.276  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.302  -0.098   0.660  1.00  0.00           C  
HETATM   10  N   UNL     1      -5.137   0.206  -0.510  1.00  0.00           N  
HETATM   11  C   UNL     1      -2.185  -1.121  -0.198  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.852  -1.034  -0.554  1.00  0.00           C  
HETATM   13  N   UNL     1       1.937  -1.454   0.809  1.00  0.00           N  
HETATM   14  HA  UNL     1       1.869   0.603   1.232  1.00  0.00           H  
HETATM   15  H   UNL     1       1.494   1.268  -1.162  1.00  0.00           H  
HETATM   16  H   UNL     1       1.488  -0.456  -1.604  1.00  0.00           H  
HETATM   17  H   UNL     1      -0.318   2.223   0.142  1.00  0.00           H  
HETATM   18  H   UNL     1      -2.694   2.070   0.768  1.00  0.00           H  
HETATM   19  H   UNL     1      -4.521  -1.106   1.011  1.00  0.00           H  
HETATM   20  H   UNL     1      -4.515   0.618   1.454  1.00  0.00           H  
HETATM   21  H   UNL     1      -4.913  -0.403  -1.282  1.00  0.00           H  
HETATM   22  H   UNL     1      -6.118   0.150  -0.278  1.00  0.00           H  
HETATM   23  H   UNL     1      -2.710  -2.060  -0.294  1.00  0.00           H  
HETATM   24  H   UNL     1      -0.334  -1.907  -0.925  1.00  0.00           H  
HETATM   25  H1  UNL     1       0.986  -1.607   1.110  1.00  0.00           H  
HETATM   26  OXT UNL     1       4.110   1.396   0.055  1.00  0.00           O  
HETATM   27  HXT UNL     1       5.045   1.482  -0.176  1.00  0.00           H  
HETATM   28  H2  UNL     1       2.186  -2.085   0.062  1.00  0.00           H  
CONECT    1    2    2    3   26                                       
CONECT    2    1    1                                                 
CONECT    3    1    4   13   14                                       
CONECT    4    3    5   15   16                                       
CONECT    5    4   12    6    6                                       
CONECT    6    5    5    7   17                                       
CONECT    7    8    8    6   18                                       
CONECT    8   11    7    7    9                                       
CONECT    9    8   10   19   20                                       
CONECT   10    9   21   22                                            
CONECT   11   12   12    8   23                                       
CONECT   12   11   11    5   24                                       
CONECT   13    3   25   28                                            
CONECT   14    3                                                      
CONECT   15    4                                                      
CONECT   16    4                                                      
CONECT   17    6                                                      
CONECT   18    7                                                      
CONECT   19    9                                                      
CONECT   20    9                                                      
CONECT   21   10                                                      
CONECT   22   10                                                      
CONECT   23   11                                                      
CONECT   24   12                                                      
CONECT   25   13                                                      
CONECT   26    1   27                                                 
CONECT   27   26                                                      
CONECT   28   13                                                      
MASTER        0    0    0    0    0    0    0    0   28    0   28    0
END
