COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.034   0.186  -0.004  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.836  -2.930   0.422  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.275  -1.540   0.266  1.00  0.00           C  
HETATM    4  C   UNL     1       1.072  -1.331   0.205  1.00  0.00           C  
HETATM    5  CA  UNL     1       1.570  -0.027   0.060  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.522  -0.567   0.223  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.127  -0.423   0.174  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.558   0.869   0.027  1.00  0.00           C  
HETATM    9  N   UNL     1      -0.889   3.270  -0.210  1.00  0.00           N  
HETATM   10  N   UNL     1       0.763   1.014  -0.021  1.00  0.00           N  
HETATM   11  N   UNL     1      -1.276  -3.430  -0.887  1.00  0.00           N  
HETATM   12  O   UNL     1       3.789  -0.763   0.064  1.00  0.00           O  
HETATM   13  C   UNL     1      -1.418   1.991  -0.065  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.782   1.805  -0.012  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.323   0.531   0.132  1.00  0.00           C  
HETATM   16  H   UNL     1      -0.066  -3.589   0.824  1.00  0.00           H  
HETATM   17  H   UNL     1      -1.685  -2.904   1.105  1.00  0.00           H  
HETATM   18  H   UNL     1       1.753  -2.167   0.269  1.00  0.00           H  
HETATM   19  H   UNL     1      -2.960  -1.548   0.334  1.00  0.00           H  
HETATM   20  H   UNL     1       0.072   3.396  -0.247  1.00  0.00           H  
HETATM   21  H   UNL     1      -1.481   4.036  -0.273  1.00  0.00           H  
HETATM   22  H   UNL     1      -1.656  -4.362  -0.809  1.00  0.00           H  
HETATM   23  H   UNL     1      -1.942  -2.802  -1.309  1.00  0.00           H  
HETATM   24  H   UNL     1      -3.439   2.659  -0.083  1.00  0.00           H  
HETATM   25  H   UNL     1      -4.396   0.411   0.170  1.00  0.00           H  
HETATM   26  OXT UNL     1       3.528   1.431  -0.144  1.00  0.00           O  
HETATM   27  HXT UNL     1       4.490   1.520  -0.181  1.00  0.00           H  
CONECT    1   12   12    5   26                                       
CONECT    2   11    3   16   17                                       
CONECT    3    4    2    7    7                                       
CONECT    4    5    5    3   18                                       
CONECT    5    1    4    4   10                                       
CONECT    6    7   15   15   19                                       
CONECT    7    3    3    8    6                                       
CONECT    8   10   10    7   13                                       
CONECT    9   13   20   21                                            
CONECT   10    5    8    8                                            
CONECT   11    2   22   23                                            
CONECT   12    1    1                                                 
CONECT   13    8    9   14   14                                       
CONECT   14   13   13   15   24                                       
CONECT   15    6    6   14   25                                       
CONECT   16    2                                                      
CONECT   17    2                                                      
CONECT   18    4                                                      
CONECT   19    6                                                      
CONECT   20    9                                                      
CONECT   21    9                                                      
CONECT   22   11                                                      
CONECT   23   11                                                      
CONECT   24   14                                                      
CONECT   25   15                                                      
CONECT   26    1   27                                                 
CONECT   27   26                                                      
MASTER        0    0    0    0    0    0    0    0   27    0   27    0
END
