COMPND    HMDB0033831
HETATM    1  O1  UNL     1       0.703   2.274   2.046  1.00  0.00           O  
HETATM    2  C1  UNL     1       1.126   1.504   1.133  1.00  0.00           C  
HETATM    3  O2  UNL     1       2.393   1.506   0.761  1.00  0.00           O  
HETATM    4  C2  UNL     1       2.812   0.691  -0.197  1.00  0.00           C  
HETATM    5  C3  UNL     1       4.150   0.694  -0.589  1.00  0.00           C  
HETATM    6  C4  UNL     1       4.636  -0.132  -1.578  1.00  0.00           C  
HETATM    7  O3  UNL     1       5.992  -0.105  -1.950  1.00  0.00           O  
HETATM    8  C5  UNL     1       3.732  -0.978  -2.177  1.00  0.00           C  
HETATM    9  C6  UNL     1       2.416  -1.018  -1.830  1.00  0.00           C  
HETATM   10  C7  UNL     1       1.966  -0.172  -0.830  1.00  0.00           C  
HETATM   11  C8  UNL     1       0.628  -0.180  -0.444  1.00  0.00           C  
HETATM   12  O4  UNL     1      -0.400  -0.866  -0.842  1.00  0.00           O  
HETATM   13  C9  UNL     1      -1.486  -0.517  -0.165  1.00  0.00           C  
HETATM   14  C10 UNL     1      -2.794  -0.948  -0.220  1.00  0.00           C  
HETATM   15  C11 UNL     1      -3.756  -0.391   0.634  1.00  0.00           C  
HETATM   16  C12 UNL     1      -3.431   0.592   1.545  1.00  0.00           C  
HETATM   17  C13 UNL     1      -2.109   1.010   1.582  1.00  0.00           C  
HETATM   18  C14 UNL     1      -1.152   0.472   0.749  1.00  0.00           C  
HETATM   19  C15 UNL     1       0.198   0.668   0.551  1.00  0.00           C  
HETATM   20  O5  UNL     1      -4.596   0.920   2.223  1.00  0.00           O  
HETATM   21  C16 UNL     1      -5.704   0.455   1.441  1.00  0.00           C  
HETATM   22  O6  UNL     1      -5.110  -0.643   0.776  1.00  0.00           O  
HETATM   23  H1  UNL     1       4.835   1.366  -0.102  1.00  0.00           H  
HETATM   24  H2  UNL     1       6.582  -0.753  -1.420  1.00  0.00           H  
HETATM   25  H3  UNL     1       4.081  -1.651  -2.969  1.00  0.00           H  
HETATM   26  H4  UNL     1       1.682  -1.686  -2.296  1.00  0.00           H  
HETATM   27  H5  UNL     1      -3.078  -1.715  -0.921  1.00  0.00           H  
HETATM   28  H6  UNL     1      -1.803   1.776   2.276  1.00  0.00           H  
HETATM   29  H7  UNL     1      -5.960   1.279   0.731  1.00  0.00           H  
HETATM   30  H8  UNL     1      -6.554   0.168   2.082  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3   19
CONECT    3    4
CONECT    4    5    5   10
CONECT    5    6   23
CONECT    6    7    8    8
CONECT    7   24
CONECT    8    9   25
CONECT    9   10   10   26
CONECT   10   11
CONECT   11   12   19   19
CONECT   12   13
CONECT   13   14   14   18
CONECT   14   15   27
CONECT   15   16   16   22
CONECT   16   17   20
CONECT   17   18   18   28
CONECT   18   19
CONECT   20   21
CONECT   21   22   29   30
END