COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -1.780  -1.138   0.998  1.00  0.00           N  
HETATM    2  O   UNL     1      -4.139  -1.753  -0.056  1.00  0.00           O  
HETATM    3  C   UNL     1      -3.972  -0.569   0.117  1.00  0.00           C  
HETATM    4  CA  UNL     1      -2.603  -0.044   0.466  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.942   0.528  -0.790  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.626   1.163  -0.419  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.414   2.460  -0.148  1.00  0.00           C  
HETATM    8  C   UNL     1       0.663   0.479  -0.280  1.00  0.00           C  
HETATM    9  N   UNL     1       0.907   2.665   0.147  1.00  0.00           N  
HETATM   10  C   UNL     1       1.593   1.472   0.075  1.00  0.00           C  
HETATM   11  C   UNL     1       1.077  -0.847  -0.426  1.00  0.00           C  
HETATM   12  C   UNL     1       2.924   1.121   0.280  1.00  0.00           C  
HETATM   13  C   UNL     1       2.399  -1.174  -0.220  1.00  0.00           C  
HETATM   14  C   UNL     1       3.320  -0.191   0.133  1.00  0.00           C  
HETATM   15  F   UNL     1       4.614  -0.526   0.332  1.00  0.00           F  
HETATM   16  F   UNL     1       2.804  -2.455  -0.359  1.00  0.00           F  
HETATM   17  H1  UNL     1      -1.680  -1.878   0.320  1.00  0.00           H  
HETATM   18  H2  UNL     1      -0.879  -0.799   1.299  1.00  0.00           H  
HETATM   19  HA  UNL     1      -2.695   0.740   1.217  1.00  0.00           H  
HETATM   20  H   UNL     1      -1.769  -0.275  -1.507  1.00  0.00           H  
HETATM   21  H   UNL     1      -2.595   1.278  -1.235  1.00  0.00           H  
HETATM   22  H   UNL     1      -1.173   3.228  -0.162  1.00  0.00           H  
HETATM   23  H   UNL     1       1.301   3.521   0.376  1.00  0.00           H  
HETATM   24  H   UNL     1       0.365  -1.611  -0.699  1.00  0.00           H  
HETATM   25  H   UNL     1       3.646   1.877   0.553  1.00  0.00           H  
HETATM   26  OXT UNL     1      -5.006   0.279  -0.001  1.00  0.00           O  
HETATM   27  HXT UNL     1      -5.865  -0.105  -0.226  1.00  0.00           H  
CONECT    1    4   17   18                                            
CONECT    2    3    3                                                 
CONECT    3    2    2    4   26                                       
CONECT    4    5    3    1   19                                       
CONECT    5    6    4   20   21                                       
CONECT    6    5    8    7    7                                       
CONECT    7    6    6    9   22                                       
CONECT    8   11    6   10   10                                       
CONECT    9   10    7   23                                            
CONECT   10    8    8   12    9                                       
CONECT   11   13   13    8   24                                       
CONECT   12   14   14   10   25                                       
CONECT   13   16   11   11   14                                       
CONECT   14   13   15   12   12                                       
CONECT   15   14                                                      
CONECT   16   13                                                      
CONECT   17    1                                                      
CONECT   18    1                                                      
CONECT   19    4                                                      
CONECT   20    5                                                      
CONECT   21    5                                                      
CONECT   22    7                                                      
CONECT   23    9                                                      
CONECT   24   11                                                      
CONECT   25   12                                                      
CONECT   26    3   27                                                 
CONECT   27   26                                                      
MASTER        0    0    0    0    0    0    0    0   27    0   27    0
END
