COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.348   2.146   1.312  1.00  0.00           C  
HETATM    2  N   UNL     1      -2.095   1.427   0.056  1.00  0.00           N  
HETATM    3  CA  UNL     1      -2.311  -0.016   0.223  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.772  -0.331   0.032  1.00  0.00           C  
HETATM    5  O   UNL     1      -4.206  -1.596   0.139  1.00  0.00           O  
HETATM    6  C   UNL     1      -1.485  -0.779  -0.816  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.018  -0.562  -0.549  1.00  0.00           C  
HETATM    8  C   UNL     1       0.664  -1.426   0.290  1.00  0.00           C  
HETATM    9  C   UNL     1       2.007  -1.233   0.539  1.00  0.00           C  
HETATM   10  C   UNL     1       2.678  -0.163  -0.057  1.00  0.00           C  
HETATM   11  C   UNL     1       4.116   0.049   0.205  1.00  0.00           C  
HETATM   12  O   UNL     1       4.761   1.082  -0.373  1.00  0.00           O  
HETATM   13  O   UNL     1       4.718  -0.707   0.940  1.00  0.00           O  
HETATM   14  C   UNL     1       1.984   0.704  -0.903  1.00  0.00           C  
HETATM   15  C   UNL     1       0.642   0.496  -1.147  1.00  0.00           C  
HETATM   16  H   UNL     1      -3.380   1.981   1.623  1.00  0.00           H  
HETATM   17  H   UNL     1      -1.673   1.778   2.084  1.00  0.00           H  
HETATM   18  H   UNL     1      -2.181   3.212   1.160  1.00  0.00           H  
HETATM   19  H   UNL     1      -1.165   1.616  -0.287  1.00  0.00           H  
HETATM   20  HA  UNL     1      -2.002  -0.317   1.224  1.00  0.00           H  
HETATM   21  H   UNL     1      -1.713  -1.843  -0.751  1.00  0.00           H  
HETATM   22  H   UNL     1      -1.730  -0.415  -1.813  1.00  0.00           H  
HETATM   23  H   UNL     1       0.144  -2.252   0.751  1.00  0.00           H  
HETATM   24  H   UNL     1       2.539  -1.907   1.194  1.00  0.00           H  
HETATM   25  H   UNL     1       5.701   1.180  -0.171  1.00  0.00           H  
HETATM   26  H   UNL     1       2.497   1.531  -1.371  1.00  0.00           H  
HETATM   27  H   UNL     1       0.104   1.166  -1.801  1.00  0.00           H  
HETATM   28  OXT UNL     1      -4.553   0.557  -0.218  1.00  0.00           O  
HETATM   29  H   UNL     1      -5.152  -1.749   0.008  1.00  0.00           H  
CONECT    1    2   16   17   18                                       
CONECT    2    3    1   19                                            
CONECT    3    4    2    6   20                                       
CONECT    4    3    5   28   28                                       
CONECT    5    4   29                                                 
CONECT    6    3    7   21   22                                       
CONECT    7   15    6    8    8                                       
CONECT    8    7    7    9   23                                       
CONECT    9   10   10    8   24                                       
CONECT   10   14   11    9    9                                       
CONECT   11   13   13   10   12                                       
CONECT   12   11   25                                                 
CONECT   13   11   11                                                 
CONECT   14   15   15   10   26                                       
CONECT   15   14   14    7   27                                       
CONECT   16    1                                                      
CONECT   17    1                                                      
CONECT   18    1                                                      
CONECT   19    2                                                      
CONECT   20    3                                                      
CONECT   21    6                                                      
CONECT   22    6                                                      
CONECT   23    8                                                      
CONECT   24    9                                                      
CONECT   25   12                                                      
CONECT   26   14                                                      
CONECT   27   15                                                      
CONECT   28    4    4                                                 
CONECT   29    5                                                      
MASTER        0    0    0    0    0    0    0    0   29    0   29    0
END
