COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.505   0.297  -0.037  1.00  0.00           C  
HETATM    2  O   UNL     1       4.165  -0.036   0.919  1.00  0.00           O  
HETATM    3  OXT UNL     1       3.886   1.346  -0.783  1.00  0.00           O  
HETATM    4  CA  UNL     1       2.258  -0.469  -0.396  1.00  0.00           C  
HETATM    5  N   UNL     1       2.308  -1.801   0.221  1.00  0.00           N  
HETATM    6  C   UNL     1       1.030   0.286   0.119  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.240  -0.426  -0.352  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.467   0.329   0.162  1.00  0.00           C  
HETATM    9  N   UNL     1      -2.684  -0.352  -0.289  1.00  0.00           N  
HETATM   10  C   UNL     1      -3.894   0.137   0.047  1.00  0.00           C  
HETATM   11  O   UNL     1      -3.976   1.143   0.724  1.00  0.00           O  
HETATM   12  N   UNL     1      -5.012  -0.490  -0.368  1.00  0.00           N  
HETATM   13  HXT UNL     1       4.695   1.804  -0.516  1.00  0.00           H  
HETATM   14  HA  UNL     1       2.194  -0.572  -1.479  1.00  0.00           H  
HETATM   15  H1  UNL     1       2.367  -1.733   1.226  1.00  0.00           H  
HETATM   16  H2  UNL     1       1.513  -2.358  -0.057  1.00  0.00           H  
HETATM   17  H   UNL     1       1.050   0.311   1.208  1.00  0.00           H  
HETATM   18  H   UNL     1       1.041   1.304  -0.269  1.00  0.00           H  
HETATM   19  H   UNL     1      -0.259  -0.452  -1.442  1.00  0.00           H  
HETATM   20  H   UNL     1      -0.251  -1.444   0.035  1.00  0.00           H  
HETATM   21  H   UNL     1      -1.448   0.354   1.251  1.00  0.00           H  
HETATM   22  H   UNL     1      -1.457   1.347  -0.226  1.00  0.00           H  
HETATM   23  H   UNL     1      -2.618  -1.156  -0.829  1.00  0.00           H  
HETATM   24  H   UNL     1      -4.947  -1.293  -0.908  1.00  0.00           H  
HETATM   25  H   UNL     1      -5.884  -0.138  -0.126  1.00  0.00           H  
CONECT    1    2    2    3    4                                       
CONECT    2    1    1                                                 
CONECT    3    1   13                                                 
CONECT    4    1    5    6   14                                       
CONECT    5    4   15   16                                            
CONECT    6    4    7   17   18                                       
CONECT    7    6    8   19   20                                       
CONECT    8    7    9   21   22                                       
CONECT    9    8   10   23                                            
CONECT   10    9   11   11   12                                       
CONECT   11   10   10                                                 
CONECT   12   10   24   25                                            
CONECT   13    3                                                      
CONECT   14    4                                                      
CONECT   15    5                                                      
CONECT   16    5                                                      
CONECT   17    6                                                      
CONECT   18    6                                                      
CONECT   19    7                                                      
CONECT   20    7                                                      
CONECT   21    8                                                      
CONECT   22    8                                                      
CONECT   23    9                                                      
CONECT   24   12                                                      
CONECT   25   12                                                      
MASTER        0    0    0    0    0    0    0    0   25    0   25    0
END
