COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  OXT UNL     1      -3.361  -1.280  -0.814  1.00  0.00           O  
HETATM    2  C   UNL     1      -2.948  -0.253  -0.055  1.00  0.00           C  
HETATM    3  N   UNL     1      -1.641   1.773   0.252  1.00  0.00           N  
HETATM    4  O   UNL     1      -3.619   0.116   0.880  1.00  0.00           O  
HETATM    5  CA  UNL     1      -1.648   0.441  -0.368  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.483  -0.384   0.183  1.00  0.00           C  
HETATM    7  N   UNL     1       1.956  -0.536   0.286  1.00  0.00           N  
HETATM    8  C   UNL     1       3.245  -0.155   0.032  1.00  0.00           C  
HETATM    9  C   UNL     1       0.841   0.254  -0.242  1.00  0.00           C  
HETATM   10  N   UNL     1       4.258  -0.874   0.512  1.00  0.00           N  
HETATM   11  N   UNL     1       3.486   0.934  -0.695  1.00  0.00           N1+
HETATM   12  H1  UNL     1      -1.738   1.705   1.254  1.00  0.00           H  
HETATM   13  HA  UNL     1      -1.541   0.543  -1.448  1.00  0.00           H  
HETATM   14  H   UNL     1       1.780  -1.330   0.815  1.00  0.00           H  
HETATM   15  H   UNL     1      -0.540  -0.412   1.271  1.00  0.00           H  
HETATM   16  H   UNL     1      -0.540  -1.400  -0.209  1.00  0.00           H  
HETATM   17  H   UNL     1       0.898   0.281  -1.330  1.00  0.00           H  
HETATM   18  H   UNL     1       0.897   1.269   0.150  1.00  0.00           H  
HETATM   19  H   UNL     1       5.172  -0.604   0.332  1.00  0.00           H  
HETATM   20  H   UNL     1       4.082  -1.667   1.041  1.00  0.00           H  
HETATM   21  H   UNL     1       2.748   1.457  -1.045  1.00  0.00           H  
HETATM   22  H   UNL     1       4.400   1.204  -0.875  1.00  0.00           H  
HETATM   23  H2  UNL     1      -0.807   2.283   0.003  1.00  0.00           H  
HETATM   24  HXT UNL     1      -4.201  -1.694  -0.574  1.00  0.00           H  
CONECT    1    2   24                                                 
CONECT    2    4    4    5    1                                       
CONECT    3    5   12   23                                            
CONECT    4    2    2                                                 
CONECT    5    2    3   13    6                                       
CONECT    6    5   15   16    9                                       
CONECT    7   14    8    9                                            
CONECT    8    7   10   11   11                                       
CONECT    9    6    7   18   17                                       
CONECT   10    8   19   20                                            
CONECT   11    8    8   22   21                                       
CONECT   12    3                                                      
CONECT   13    5                                                      
CONECT   14    7                                                      
CONECT   15    6                                                      
CONECT   16    6                                                      
CONECT   17    9                                                      
CONECT   18    9                                                      
CONECT   19   10                                                      
CONECT   20   10                                                      
CONECT   21   11                                                      
CONECT   22   11                                                      
CONECT   23    3                                                      
CONECT   24    1                                                      
MASTER        0    0    0    0    0    0    0    0   24    0   24    0
END
