COMPND    HMDB0032018
HETATM    1  O1  UNL     1      -0.443  -1.582   0.884  1.00  0.00           O  
HETATM    2  C1  UNL     1       0.238  -0.643   0.403  1.00  0.00           C  
HETATM    3  O2  UNL     1      -0.414   0.522   0.034  1.00  0.00           O  
HETATM    4  C2  UNL     1      -1.786   0.645   0.193  1.00  0.00           C  
HETATM    5  C3  UNL     1      -2.637   0.256  -0.847  1.00  0.00           C  
HETATM    6  C4  UNL     1      -4.006   0.364  -0.725  1.00  0.00           C  
HETATM    7  C5  UNL     1      -4.539   0.863   0.444  1.00  0.00           C  
HETATM    8  C6  UNL     1      -3.696   1.252   1.482  1.00  0.00           C  
HETATM    9  C7  UNL     1      -2.308   1.145   1.365  1.00  0.00           C  
HETATM   10  C8  UNL     1       1.671  -0.736   0.222  1.00  0.00           C  
HETATM   11  C9  UNL     1       2.329  -1.887   0.584  1.00  0.00           C  
HETATM   12  C10 UNL     1       3.699  -1.967   0.407  1.00  0.00           C  
HETATM   13  C11 UNL     1       4.397  -0.907  -0.125  1.00  0.00           C  
HETATM   14  C12 UNL     1       3.753   0.252  -0.493  1.00  0.00           C  
HETATM   15  C13 UNL     1       2.384   0.316  -0.310  1.00  0.00           C  
HETATM   16  O3  UNL     1       1.713   1.485  -0.678  1.00  0.00           O  
HETATM   17  H1  UNL     1      -2.182  -0.128  -1.741  1.00  0.00           H  
HETATM   18  H2  UNL     1      -4.662   0.063  -1.528  1.00  0.00           H  
HETATM   19  H3  UNL     1      -5.616   0.934   0.507  1.00  0.00           H  
HETATM   20  H4  UNL     1      -4.127   1.634   2.374  1.00  0.00           H  
HETATM   21  H5  UNL     1      -1.709   1.460   2.196  1.00  0.00           H  
HETATM   22  H6  UNL     1       1.765  -2.726   1.007  1.00  0.00           H  
HETATM   23  H7  UNL     1       4.185  -2.901   0.709  1.00  0.00           H  
HETATM   24  H8  UNL     1       5.480  -1.042  -0.236  1.00  0.00           H  
HETATM   25  H9  UNL     1       4.337   1.054  -0.904  1.00  0.00           H  
HETATM   26  H10 UNL     1       2.175   2.274  -1.065  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3   10
CONECT    3    4
CONECT    4    5    5    9
CONECT    5    6   17
CONECT    6    7    7   18
CONECT    7    8   19
CONECT    8    9    9   20
CONECT    9   21
CONECT   10   11   11   15
CONECT   11   12   22
CONECT   12   13   13   23
CONECT   13   14   24
CONECT   14   15   15   25
CONECT   15   16
CONECT   16   26
END