COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.083  -0.210   0.118  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.867  -0.384  -0.100  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.679   0.475   0.252  1.00  0.00           C  
HETATM    4  N   UNL     1       1.845   1.763  -0.574  1.00  0.00           N  
HETATM    5  OXT UNL     1       3.474  -1.079   1.064  1.00  0.00           O  
HETATM    6  O   UNL     1      -1.697  -1.497  -0.551  1.00  0.00           O  
HETATM    7  N   UNL     1      -3.116   0.085   0.086  1.00  0.00           N  
HETATM    8  C   UNL     1      -3.321   1.430   0.631  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.271  -0.750  -0.256  1.00  0.00           C  
HETATM   10  CA  UNL     1       1.816   0.584   0.303  1.00  0.00           C  
HETATM   11  C   UNL     1       0.611  -0.288  -0.054  1.00  0.00           C  
HETATM   12  O   UNL     1       3.750  -0.061  -0.878  1.00  0.00           O  
HETATM   13  H   UNL     1      -0.707   1.392  -0.337  1.00  0.00           H  
HETATM   14  H   UNL     1      -0.712   0.724   1.312  1.00  0.00           H  
HETATM   15  H1  UNL     1       1.918   1.491  -1.543  1.00  0.00           H  
HETATM   16  H2  UNL     1       1.036   2.346  -0.422  1.00  0.00           H  
HETATM   17  HXT UNL     1       4.294  -1.566   0.900  1.00  0.00           H  
HETATM   18  H   UNL     1      -3.369   2.149  -0.187  1.00  0.00           H  
HETATM   19  H   UNL     1      -4.254   1.456   1.193  1.00  0.00           H  
HETATM   20  H   UNL     1      -2.492   1.684   1.291  1.00  0.00           H  
HETATM   21  H   UNL     1      -3.924  -1.708  -0.643  1.00  0.00           H  
HETATM   22  H   UNL     1      -4.876  -0.916   0.635  1.00  0.00           H  
HETATM   23  H   UNL     1      -4.871  -0.247  -1.014  1.00  0.00           H  
HETATM   24  HA  UNL     1       1.737   0.906   1.342  1.00  0.00           H  
HETATM   25  H   UNL     1       0.639  -1.205   0.535  1.00  0.00           H  
HETATM   26  H   UNL     1       0.644  -0.536  -1.115  1.00  0.00           H  
CONECT    1   12   12    5   10                                       
CONECT    2    3    6    6    7                                       
CONECT    3    2   11   13   14                                       
CONECT    4   10   15   16                                            
CONECT    5    1   17                                                 
CONECT    6    2    2                                                 
CONECT    7    2    8    9                                            
CONECT    8    7   18   19   20                                       
CONECT    9    7   21   22   23                                       
CONECT   10    1    4   11   24                                       
CONECT   11    3   10   25   26                                       
CONECT   12    1    1                                                 
CONECT   13    3                                                      
CONECT   14    3                                                      
CONECT   15    4                                                      
CONECT   16    4                                                      
CONECT   17    5                                                      
CONECT   18    8                                                      
CONECT   19    8                                                      
CONECT   20    8                                                      
CONECT   21    9                                                      
CONECT   22    9                                                      
CONECT   23    9                                                      
CONECT   24   10                                                      
CONECT   25   11                                                      
CONECT   26   11                                                      
MASTER        0    0    0    0    0    0    0    0   26    0   26    0
END
