COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       2.610   0.774   1.671  1.00  0.00           N  
HETATM    2  CA  UNL     1       2.179  -0.320   0.790  1.00  0.00           C  
HETATM    3  C   UNL     1       2.958  -0.263  -0.499  1.00  0.00           C  
HETATM    4  C   UNL     1       0.709  -0.178   0.494  1.00  0.00           C  
HETATM    5  C   UNL     1       0.170   1.073   0.258  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.099  -1.298   0.455  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.184   1.206  -0.015  1.00  0.00           C  
HETATM    8  O   UNL     1      -1.713   2.436  -0.247  1.00  0.00           O  
HETATM    9  C   UNL     1      -1.453  -1.170   0.182  1.00  0.00           C  
HETATM   10  O   UNL     1      -2.246  -2.273   0.143  1.00  0.00           O  
HETATM   11  C   UNL     1      -1.997   0.084  -0.050  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.114   2.499  -0.521  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.631  -2.066  -0.144  1.00  0.00           C  
HETATM   14  O   UNL     1       3.506   0.763  -0.829  1.00  0.00           O  
HETATM   15  H1  UNL     1       3.577   0.665   1.936  1.00  0.00           H  
HETATM   16  H2  UNL     1       2.452   1.671   1.237  1.00  0.00           H  
HETATM   17  HA  UNL     1       2.360  -1.276   1.282  1.00  0.00           H  
HETATM   18  H   UNL     1       0.804   1.947   0.285  1.00  0.00           H  
HETATM   19  H   UNL     1       0.325  -2.275   0.636  1.00  0.00           H  
HETATM   20  H   UNL     1      -3.051   0.186  -0.261  1.00  0.00           H  
HETATM   21  H   UNL     1      -3.668   2.098   0.327  1.00  0.00           H  
HETATM   22  H   UNL     1      -3.405   3.536  -0.688  1.00  0.00           H  
HETATM   23  H   UNL     1      -3.337   1.911  -1.411  1.00  0.00           H  
HETATM   24  H   UNL     1      -4.067  -1.419   0.617  1.00  0.00           H  
HETATM   25  H   UNL     1      -3.733  -1.597  -1.122  1.00  0.00           H  
HETATM   26  H   UNL     1      -4.149  -3.026  -0.145  1.00  0.00           H  
HETATM   27  OXT UNL     1       3.044  -1.351  -1.280  1.00  0.00           O  
HETATM   28  HXT UNL     1       3.555  -1.266  -2.097  1.00  0.00           H  
CONECT    1    2   15   16                                            
CONECT    2    1    4    3   17                                       
CONECT    3   14   14    2   27                                       
CONECT    4    2    5    5    6                                       
CONECT    5    4    4    7   18                                       
CONECT    6    4    9    9   19                                       
CONECT    7    5    8   11   11                                       
CONECT    8    7   12                                                 
CONECT    9    6    6   11   10                                       
CONECT   10    9   13                                                 
CONECT   11    7    7    9   20                                       
CONECT   12    8   21   22   23                                       
CONECT   13   10   24   25   26                                       
CONECT   14    3    3                                                 
CONECT   15    1                                                      
CONECT   16    1                                                      
CONECT   17    2                                                      
CONECT   18    5                                                      
CONECT   19    6                                                      
CONECT   20   11                                                      
CONECT   21   12                                                      
CONECT   22   12                                                      
CONECT   23   12                                                      
CONECT   24   13                                                      
CONECT   25   13                                                      
CONECT   26   13                                                      
CONECT   27    3   28                                                 
CONECT   28   27                                                      
MASTER        0    0    0    0    0    0    0    0   28    0   28    0
END
