COMPND    HMDB0040528
HETATM    1  O1  UNL     1      -3.320  -1.477   1.029  1.00  0.00           O  
HETATM    2  C1  UNL     1      -2.317  -0.850   0.554  1.00  0.00           C  
HETATM    3  C2  UNL     1      -2.452   0.600   0.244  1.00  0.00           C  
HETATM    4  O2  UNL     1      -1.196   1.225   0.485  1.00  0.00           O  
HETATM    5  C3  UNL     1       0.012   0.593   0.259  1.00  0.00           C  
HETATM    6  C4  UNL     1       1.152   1.371   0.118  1.00  0.00           C  
HETATM    7  C5  UNL     1       2.364   0.769  -0.107  1.00  0.00           C  
HETATM    8  C6  UNL     1       2.424  -0.618  -0.190  1.00  0.00           C  
HETATM    9  C7  UNL     1       1.282  -1.399  -0.049  1.00  0.00           C  
HETATM   10  C8  UNL     1       0.057  -0.779   0.179  1.00  0.00           C  
HETATM   11  O3  UNL     1      -1.115  -1.502   0.328  1.00  0.00           O  
HETATM   12  H1  UNL     1      -3.246   1.036   0.891  1.00  0.00           H  
HETATM   13  H2  UNL     1      -2.665   0.744  -0.838  1.00  0.00           H  
HETATM   14  H3  UNL     1       1.056   2.444   0.190  1.00  0.00           H  
HETATM   15  H4  UNL     1       3.244   1.395  -0.215  1.00  0.00           H  
HETATM   16  H5  UNL     1       3.385  -1.086  -0.368  1.00  0.00           H  
HETATM   17  H6  UNL     1       1.335  -2.464  -0.114  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3   11
CONECT    3    4   12   13
CONECT    4    5
CONECT    5    6    6   10
CONECT    6    7   14
CONECT    7    8    8   15
CONECT    8    9   16
CONECT    9   10   10   17
CONECT   10   11
END