COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.017  -2.649  -0.844  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.922  -2.961   1.141  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.067  -1.877   1.176  1.00  0.00           C  
HETATM    4  C   UNL     1       3.982   0.871  -0.063  1.00  0.00           C  
HETATM    5  N   UNL     1      -1.819   0.575  -1.460  1.00  0.00           N  
HETATM    6  CA  UNL     1      -1.651   1.676  -0.502  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.007   1.143   0.779  1.00  0.00           C  
HETATM    8  C   UNL     1       0.388   0.660   0.477  1.00  0.00           C  
HETATM    9  C   UNL     1       1.507   1.420   0.423  1.00  0.00           C  
HETATM   10  C   UNL     1       2.558   0.525   0.109  1.00  0.00           C  
HETATM   11  N   UNL     1       2.025  -0.676  -0.003  1.00  0.00           N  
HETATM   12  N   UNL     1       0.760  -0.620   0.215  1.00  0.00           N  
HETATM   13  C   UNL     1      -0.110  -1.718   0.182  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.879  -3.727  -0.876  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.830  -3.884   0.115  1.00  0.00           C  
HETATM   16  O   UNL     1       4.347   2.023   0.066  1.00  0.00           O  
HETATM   17  O   UNL     1       4.878  -0.090  -0.363  1.00  0.00           O  
HETATM   18  C   UNL     1      -2.997   2.270  -0.178  1.00  0.00           C  
HETATM   19  O   UNL     1      -4.004   1.634  -0.383  1.00  0.00           O  
HETATM   20  OXT UNL     1      -3.079   3.507   0.337  1.00  0.00           O  
HETATM   21  H   UNL     1       0.726  -2.527  -1.618  1.00  0.00           H  
HETATM   22  H   UNL     1      -2.667  -3.086   1.913  1.00  0.00           H  
HETATM   23  H   UNL     1      -1.139  -1.157   1.977  1.00  0.00           H  
HETATM   24  H1  UNL     1      -2.409  -0.149  -1.079  1.00  0.00           H  
HETATM   25  H2  UNL     1      -2.183   0.913  -2.339  1.00  0.00           H  
HETATM   26  HA  UNL     1      -1.011   2.443  -0.938  1.00  0.00           H  
HETATM   27  H   UNL     1      -0.964   1.939   1.523  1.00  0.00           H  
HETATM   28  H   UNL     1      -1.602   0.316   1.168  1.00  0.00           H  
HETATM   29  H   UNL     1       1.582   2.485   0.585  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.810  -4.450  -1.676  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.500  -4.730   0.090  1.00  0.00           H  
HETATM   32  H   UNL     1       5.799   0.186  -0.466  1.00  0.00           H  
HETATM   33  HXT UNL     1      -3.964   3.846   0.529  1.00  0.00           H  
CONECT    1   14   14   13   21                                       
CONECT    2   15   15    3   22                                       
CONECT    3    2   13   13   23                                       
CONECT    4   10   16   16   17                                       
CONECT    5    6   24   25                                            
CONECT    6    7    5   18   26                                       
CONECT    7    8    6   27   28                                       
CONECT    8    7   12    9    9                                       
CONECT    9    8    8   10   29                                       
CONECT   10   11   11    9    4                                       
CONECT   11   12   10   10                                            
CONECT   12   13    8   11                                            
CONECT   13    3    3    1   12                                       
CONECT   14   15    1    1   30                                       
CONECT   15    2    2   14   31                                       
CONECT   16    4    4                                                 
CONECT   17    4   32                                                 
CONECT   18    6   19   19   20                                       
CONECT   19   18   18                                                 
CONECT   20   18   33                                                 
CONECT   21    1                                                      
CONECT   22    2                                                      
CONECT   23    3                                                      
CONECT   24    5                                                      
CONECT   25    5                                                      
CONECT   26    6                                                      
CONECT   27    7                                                      
CONECT   28    7                                                      
CONECT   29    9                                                      
CONECT   30   14                                                      
CONECT   31   15                                                      
CONECT   32   17                                                      
CONECT   33   20                                                      
MASTER        0    0    0    0    0    0    0    0   33    0   33    0
END
