COMPND    HMDB0033205
HETATM    1  O1  UNL     1      -2.200  -2.501   0.976  1.00  0.00           O  
HETATM    2  N1  UNL     1      -2.548  -1.365   0.667  1.00  0.00           N1+
HETATM    3  O2  UNL     1      -3.820  -0.894   0.828  1.00  0.00           O1-
HETATM    4  C1  UNL     1      -1.566  -0.493   0.112  1.00  0.00           C  
HETATM    5  C2  UNL     1      -0.223  -0.635   0.415  1.00  0.00           C  
HETATM    6  C3  UNL     1       0.745   0.190  -0.109  1.00  0.00           C  
HETATM    7 AS1  UNL     1       2.616  -0.046   0.345  1.00  0.00          AS  
HETATM    8  O3  UNL     1       3.551   0.022  -1.015  1.00  0.00           O  
HETATM    9  O4  UNL     1       3.205   1.177   1.555  1.00  0.00           O  
HETATM   10  O5  UNL     1       2.857  -1.733   1.077  1.00  0.00           O  
HETATM   11  C4  UNL     1       0.321   1.187  -0.967  1.00  0.00           C  
HETATM   12  C5  UNL     1      -1.019   1.333  -1.272  1.00  0.00           C  
HETATM   13  C6  UNL     1      -1.989   0.506  -0.746  1.00  0.00           C  
HETATM   14  O6  UNL     1      -3.350   0.660  -1.061  1.00  0.00           O  
HETATM   15  H1  UNL     1       0.073  -1.432   1.092  1.00  0.00           H  
HETATM   16  H2  UNL     1       3.572   0.779   2.373  1.00  0.00           H  
HETATM   17  H3  UNL     1       3.715  -2.125   0.759  1.00  0.00           H  
HETATM   18  H4  UNL     1       1.065   1.860  -1.399  1.00  0.00           H  
HETATM   19  H5  UNL     1      -1.362   2.114  -1.946  1.00  0.00           H  
HETATM   20  H6  UNL     1      -3.642   1.398  -1.685  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3    4
CONECT    4    5    5   13
CONECT    5    6   15
CONECT    6    7   11   11
CONECT    7    8    8    9   10
CONECT    9   16
CONECT   10   17
CONECT   11   12   18
CONECT   12   13   13   19
CONECT   13   14
CONECT   14   20
END