COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       1.942   0.434  -1.437  1.00  0.00           N  
HETATM    2  C   UNL     1       0.805   1.378  -1.408  1.00  0.00           C  
HETATM    3  CA  UNL     1       2.536   0.473  -0.076  1.00  0.00           C  
HETATM    4  C   UNL     1       3.318  -0.786   0.200  1.00  0.00           C  
HETATM    5  O   UNL     1       3.127  -1.774  -0.470  1.00  0.00           O  
HETATM    6  C   UNL     1       1.296   0.560   0.849  1.00  0.00           C  
HETATM    7  C   UNL     1       0.337   1.477   0.056  1.00  0.00           C  
HETATM    8  N   UNL     1      -1.042   1.001   0.183  1.00  0.00           N  
HETATM    9  N   UNL     1      -1.924   1.454   1.003  1.00  0.00           N  
HETATM   10  N   UNL     1      -3.033   0.819   0.858  1.00  0.00           N  
HETATM   11  C   UNL     1      -1.610   0.013  -0.547  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.884  -0.099  -0.103  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.929  -1.066  -0.598  1.00  0.00           C  
HETATM   14  N   UNL     1      -3.943  -2.255   0.264  1.00  0.00           N  
HETATM   15  H   UNL     1       1.126   2.358  -1.762  1.00  0.00           H  
HETATM   16  H   UNL     1      -0.006   1.003  -2.032  1.00  0.00           H  
HETATM   17  HA  UNL     1       3.170   1.352   0.042  1.00  0.00           H  
HETATM   18  H   UNL     1       0.417   2.505   0.410  1.00  0.00           H  
HETATM   19  H   UNL     1       0.854  -0.425   0.996  1.00  0.00           H  
HETATM   20  H   UNL     1       1.560   1.013   1.805  1.00  0.00           H  
HETATM   21  H   UNL     1      -1.140  -0.571  -1.325  1.00  0.00           H  
HETATM   22  H   UNL     1      -4.908  -0.587  -0.572  1.00  0.00           H  
HETATM   23  H   UNL     1      -3.696  -1.361  -1.620  1.00  0.00           H  
HETATM   24  H   UNL     1      -4.637  -2.919  -0.047  1.00  0.00           H  
HETATM   25  H   UNL     1       1.633  -0.498  -1.670  1.00  0.00           H  
HETATM   26  H   UNL     1      -3.030  -2.681   0.309  1.00  0.00           H  
HETATM   27  OXT UNL     1       4.225  -0.809   1.188  1.00  0.00           O  
HETATM   28  HXT UNL     1       4.702  -1.639   1.327  1.00  0.00           H  
CONECT    1    2    3   25                                            
CONECT    2    1    7   15   16                                       
CONECT    3    1    4    6   17                                       
CONECT    4    3    5    5   27                                       
CONECT    5    4    4                                                 
CONECT    6    3    7   19   20                                       
CONECT    7    2    6    8   18                                       
CONECT    8    7    9   11                                            
CONECT    9    8   10   10                                            
CONECT   10    9    9   12                                            
CONECT   11    8   12   12   21                                       
CONECT   12   10   11   11   13                                       
CONECT   13   12   14   22   23                                       
CONECT   14   13   24   26                                            
CONECT   15    2                                                      
CONECT   16    2                                                      
CONECT   17    3                                                      
CONECT   18    7                                                      
CONECT   19    6                                                      
CONECT   20    6                                                      
CONECT   21   11                                                      
CONECT   22   13                                                      
CONECT   23   13                                                      
CONECT   24   14                                                      
CONECT   25    1                                                      
CONECT   26   14                                                      
CONECT   27    4   28                                                 
CONECT   28   27                                                      
MASTER        0    0    0    0    0    0    0    0   28    0   28    0
END
