COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.509   0.343   0.017  1.00  0.00           C  
HETATM    2  N   UNL     1       2.380  -1.794  -0.234  1.00  0.00           N  
HETATM    3  O   UNL     1       4.163   0.037  -0.952  1.00  0.00           O  
HETATM    4  CA  UNL     1       2.297  -0.469   0.395  1.00  0.00           C  
HETATM    5  C   UNL     1       1.034   0.247  -0.088  1.00  0.00           C  
HETATM    6  O   UNL     1      -3.852   1.156  -0.728  1.00  0.00           O  
HETATM    7  O   UNL     1      -5.153  -0.340   0.250  1.00  0.00           O  
HETATM    8  C   UNL     1      -1.464   0.204  -0.080  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.201  -0.512   0.403  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.699  -0.555   0.411  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.944   0.150  -0.064  1.00  0.00           C  
HETATM   12  OXT UNL     1       3.866   1.402   0.760  1.00  0.00           O  
HETATM   13  H1  UNL     1       2.416  -1.716  -1.239  1.00  0.00           H  
HETATM   14  H2  UNL     1       3.171  -2.312   0.118  1.00  0.00           H  
HETATM   15  HA  UNL     1       2.259  -0.582   1.478  1.00  0.00           H  
HETATM   16  H   UNL     1       1.018   1.262   0.308  1.00  0.00           H  
HETATM   17  H   UNL     1       1.029   0.281  -1.178  1.00  0.00           H  
HETATM   18  H   UNL     1      -5.922   0.147  -0.078  1.00  0.00           H  
HETATM   19  H   UNL     1      -1.480   1.219   0.316  1.00  0.00           H  
HETATM   20  H   UNL     1      -1.469   0.238  -1.169  1.00  0.00           H  
HETATM   21  H   UNL     1      -0.185  -1.527   0.007  1.00  0.00           H  
HETATM   22  H   UNL     1      -0.197  -0.546   1.492  1.00  0.00           H  
HETATM   23  H   UNL     1      -2.683  -1.570   0.016  1.00  0.00           H  
HETATM   24  H   UNL     1      -2.695  -0.589   1.501  1.00  0.00           H  
HETATM   25  HXT UNL     1       4.651   1.892   0.478  1.00  0.00           H  
CONECT    1    3    3    4   12                                       
CONECT    2    4   13   14                                            
CONECT    3    1    1                                                 
CONECT    4    1    2    5   15                                       
CONECT    5    4    9   16   17                                       
CONECT    6   11   11                                                 
CONECT    7   11   18                                                 
CONECT    8    9   10   19   20                                       
CONECT    9    5    8   21   22                                       
CONECT   10    8   11   23   24                                       
CONECT   11    6    6    7   10                                       
CONECT   12    1   25                                                 
CONECT   13    2                                                      
CONECT   14    2                                                      
CONECT   15    4                                                      
CONECT   16    5                                                      
CONECT   17    5                                                      
CONECT   18    7                                                      
CONECT   19    8                                                      
CONECT   20    8                                                      
CONECT   21    9                                                      
CONECT   22    9                                                      
CONECT   23   10                                                      
CONECT   24   10                                                      
CONECT   25   12                                                      
MASTER        0    0    0    0    0    0    0    0   25    0   25    0
END
