COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -1.295   0.467  -0.230  1.00  0.00           N  
HETATM    2  CA  UNL     1      -0.491   1.063   0.845  1.00  0.00           C  
HETATM    3  C   UNL     1       0.945   1.262   0.356  1.00  0.00           C  
HETATM    4  OXT UNL     1       4.273   0.733  -2.378  1.00  0.00           O  
HETATM    5  CA  UNL     1       2.925   0.096  -0.410  1.00  0.00           C  
HETATM    6  CB  UNL     1       3.614  -1.258  -0.237  1.00  0.00           C  
HETATM    7  CG  UNL     1       3.590  -1.653   1.217  1.00  0.00           C  
HETATM    8  N   UNL     1      -3.647   0.159  -1.750  1.00  0.00           N  
HETATM    9  CA  UNL     1      -3.232  -0.908  -0.829  1.00  0.00           C  
HETATM   10  OD1 UNL     1       3.074  -0.924   2.032  1.00  0.00           O  
HETATM   11  C   UNL     1      -2.419  -0.303   0.318  1.00  0.00           C  
HETATM   12  C   UNL     1       3.056   0.548  -1.842  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.079   2.395   1.232  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.453  -1.594  -0.272  1.00  0.00           C  
HETATM   15  N   UNL     1       1.502  -0.031  -0.066  1.00  0.00           N  
HETATM   16  OD2 UNL     1       4.141  -2.812   1.607  1.00  0.00           O  
HETATM   17  O   UNL     1       2.067   0.744  -2.507  1.00  0.00           O  
HETATM   18  O   UNL     1      -2.066   2.806   0.670  1.00  0.00           O  
HETATM   19  OXT UNL     1      -0.505   3.126   2.201  1.00  0.00           O  
HETATM   20  O   UNL     1      -5.525  -1.038  -0.303  1.00  0.00           O  
HETATM   21  OXT UNL     1      -4.349  -2.823   0.257  1.00  0.00           O  
HETATM   22  H   UNL     1      -0.725  -0.106  -0.834  1.00  0.00           H  
HETATM   23  HA  UNL     1      -0.492   0.400   1.710  1.00  0.00           H  
HETATM   24  H   UNL     1       0.950   1.952  -0.486  1.00  0.00           H  
HETATM   25  H   UNL     1       1.551   1.671   1.165  1.00  0.00           H  
HETATM   26  HXT UNL     1       4.307   1.023  -3.300  1.00  0.00           H  
HETATM   27  HA  UNL     1       3.393   0.829   0.247  1.00  0.00           H  
HETATM   28  HB1 UNL     1       3.090  -2.011  -0.826  1.00  0.00           H  
HETATM   29  HB2 UNL     1       4.647  -1.186  -0.577  1.00  0.00           H  
HETATM   30  H1  UNL     1      -4.216   0.844  -1.276  1.00  0.00           H  
HETATM   31  H2  UNL     1      -2.847   0.592  -2.185  1.00  0.00           H  
HETATM   32  HA  UNL     1      -2.620  -1.633  -1.365  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.037  -1.103   0.953  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.057   0.355   0.908  1.00  0.00           H  
HETATM   35  H   UNL     1       0.977  -0.416  -0.836  1.00  0.00           H  
HETATM   36  HD2 UNL     1       4.101  -3.022   2.551  1.00  0.00           H  
HETATM   37  HXT UNL     1      -0.918   3.974   2.414  1.00  0.00           H  
HETATM   38  HXT UNL     1      -5.159  -3.223   0.601  1.00  0.00           H  
CONECT    1   11    2   22                                            
CONECT    2    1    3   13   23                                       
CONECT    3   15    2   24   25                                       
CONECT    4   12   26                                                 
CONECT    5    6   12   15   27                                       
CONECT    6    7    5   28   29                                       
CONECT    7   10   10   16    6                                       
CONECT    8    9   30   31                                            
CONECT    9    8   14   11   32                                       
CONECT   10    7    7                                                 
CONECT   11    9    1   33   34                                       
CONECT   12   17   17    4    5                                       
CONECT   13    2   18   18   19                                       
CONECT   14   20   20    9   21                                       
CONECT   15    5    3   35                                            
CONECT   16    7   36                                                 
CONECT   17   12   12                                                 
CONECT   18   13   13                                                 
CONECT   19   13   37                                                 
CONECT   20   14   14                                                 
CONECT   21   14   38                                                 
CONECT   22    1                                                      
CONECT   23    2                                                      
CONECT   24    3                                                      
CONECT   25    3                                                      
CONECT   26    4                                                      
CONECT   27    5                                                      
CONECT   28    6                                                      
CONECT   29    6                                                      
CONECT   30    8                                                      
CONECT   31    8                                                      
CONECT   32    9                                                      
CONECT   33   11                                                      
CONECT   34   11                                                      
CONECT   35   15                                                      
CONECT   36   16                                                      
CONECT   37   19                                                      
CONECT   38   21                                                      
MASTER        0    0    0    0    0    0    0    0   38    0   38    0
END
