COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.089  -1.322   0.598  1.00  0.00           C  
HETATM    2  C   UNL     1       4.208  -0.415  -0.264  1.00  0.00           C  
HETATM    3  O   UNL     1       2.982  -0.152   0.421  1.00  0.00           O  
HETATM    4  C   UNL     1       2.082   0.690  -0.302  1.00  0.00           C  
HETATM    5  C   UNL     1       1.158   1.463   0.681  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.189   1.439  -0.062  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.397   1.574   0.856  1.00  0.00           C  
HETATM    8  N   UNL     1      -2.604   1.400   0.026  1.00  0.00           N  
HETATM    9  CA  UNL     1      -2.627   0.113  -0.676  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.352  -0.080  -1.512  1.00  0.00           C  
HETATM   11  N   UNL     1      -0.214   0.058  -0.616  1.00  0.00           N  
HETATM   12  C   UNL     1       1.121  -0.164  -1.166  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.731  -1.000   0.334  1.00  0.00           C  
HETATM   14  O   UNL     1      -2.422  -0.802   1.485  1.00  0.00           O  
HETATM   15  H   UNL     1       4.570  -2.261   0.786  1.00  0.00           H  
HETATM   16  H   UNL     1       6.025  -1.523   0.075  1.00  0.00           H  
HETATM   17  H   UNL     1       5.302  -0.827   1.546  1.00  0.00           H  
HETATM   18  H   UNL     1       4.728   0.524  -0.453  1.00  0.00           H  
HETATM   19  H   UNL     1       3.996  -0.910  -1.212  1.00  0.00           H  
HETATM   20  H   UNL     1       2.638   1.387  -0.929  1.00  0.00           H  
HETATM   21  H   UNL     1       1.086   0.943   1.636  1.00  0.00           H  
HETATM   22  H   UNL     1       1.508   2.486   0.821  1.00  0.00           H  
HETATM   23  H   UNL     1      -0.209   2.182  -0.858  1.00  0.00           H  
HETATM   24  H   UNL     1      -1.364   0.805   1.628  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.403   2.562   1.316  1.00  0.00           H  
HETATM   26  HA  UNL     1      -3.495   0.080  -1.335  1.00  0.00           H  
HETATM   27  H   UNL     1      -1.351  -1.073  -1.961  1.00  0.00           H  
HETATM   28  H   UNL     1      -1.302   0.680  -2.292  1.00  0.00           H  
HETATM   29  H   UNL     1       1.159   0.163  -2.205  1.00  0.00           H  
HETATM   30  H   UNL     1       1.388  -1.219  -1.093  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.442   1.528   0.575  1.00  0.00           H  
HETATM   32  OXT UNL     1      -3.165  -2.212  -0.045  1.00  0.00           O  
HETATM   33  HXT UNL     1      -3.215  -2.895   0.638  1.00  0.00           H  
CONECT    1    2   15   16   17                                       
CONECT    2    1    3   18   19                                       
CONECT    3    4    2                                                 
CONECT    4    5   12    3   20                                       
CONECT    5    6    4   21   22                                       
CONECT    6    7    5   11   23                                       
CONECT    7    6    8   24   25                                       
CONECT    8    7    9   31                                            
CONECT    9    8   10   13   26                                       
CONECT   10    9   11   27   28                                       
CONECT   11    6   10   12                                            
CONECT   12    4   11   29   30                                       
CONECT   13    9   14   14   32                                       
CONECT   14   13   13                                                 
CONECT   15    1                                                      
CONECT   16    1                                                      
CONECT   17    1                                                      
CONECT   18    2                                                      
CONECT   19    2                                                      
CONECT   20    4                                                      
CONECT   21    5                                                      
CONECT   22    5                                                      
CONECT   23    6                                                      
CONECT   24    7                                                      
CONECT   25    7                                                      
CONECT   26    9                                                      
CONECT   27   10                                                      
CONECT   28   10                                                      
CONECT   29   12                                                      
CONECT   30   12                                                      
CONECT   31    8                                                      
CONECT   32   13   33                                                 
CONECT   33   32                                                      
MASTER        0    0    0    0    0    0    0    0   33    0   33    0
END
