COMPND    HMDB0059982
HETATM    1  O1  UNL     1      -3.367  -1.710  -1.556  1.00  0.00           O  
HETATM    2  C1  UNL     1      -3.052  -0.974  -0.603  1.00  0.00           C  
HETATM    3  O2  UNL     1      -4.001  -0.693   0.368  1.00  0.00           O  
HETATM    4  C2  UNL     1      -1.722  -0.402  -0.479  1.00  0.00           C  
HETATM    5  C3  UNL     1      -0.759  -0.668  -1.436  1.00  0.00           C  
HETATM    6  C4  UNL     1       0.516  -0.127  -1.328  1.00  0.00           C  
HETATM    7  C5  UNL     1       0.864   0.690  -0.269  1.00  0.00           C  
HETATM    8  O3  UNL     1       2.129   1.238  -0.144  1.00  0.00           O  
HETATM    9  S1  UNL     1       3.421   0.539   0.650  1.00  0.00           S  
HETATM   10  O4  UNL     1       4.493   0.110  -0.335  1.00  0.00           O  
HETATM   11  O5  UNL     1       4.094   1.546   1.571  1.00  0.00           O  
HETATM   12  O6  UNL     1       3.018  -0.810   1.545  1.00  0.00           O  
HETATM   13  C6  UNL     1      -0.117   0.937   0.669  1.00  0.00           C  
HETATM   14  C7  UNL     1      -1.395   0.406   0.577  1.00  0.00           C  
HETATM   15  H1  UNL     1      -4.387   0.229   0.518  1.00  0.00           H  
HETATM   16  H2  UNL     1      -1.052  -1.310  -2.255  1.00  0.00           H  
HETATM   17  H3  UNL     1       1.256  -0.351  -2.092  1.00  0.00           H  
HETATM   18  H4  UNL     1       2.068  -0.840   1.770  1.00  0.00           H  
HETATM   19  H5  UNL     1       0.151   1.574   1.495  1.00  0.00           H  
HETATM   20  H6  UNL     1      -2.159   0.615   1.332  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3    4
CONECT    3   15
CONECT    4    5    5   14
CONECT    5    6   16
CONECT    6    7    7   17
CONECT    7    8   13
CONECT    8    9
CONECT    9   10   10   11   11
CONECT    9   12
CONECT   12   18
CONECT   13   14   14   19
CONECT   14   20
END