COMPND    HMDB0038751
HETATM    1  O1  UNL     1       2.680   1.717   0.957  1.00  0.00           O  
HETATM    2  C1  UNL     1       2.867   1.082  -0.109  1.00  0.00           C  
HETATM    3  O2  UNL     1       2.796   1.715  -1.338  1.00  0.00           O  
HETATM    4  C2  UNL     1       3.173  -0.384  -0.062  1.00  0.00           C  
HETATM    5  O3  UNL     1       3.283  -0.905  -1.330  1.00  0.00           O  
HETATM    6  C3  UNL     1       2.302  -1.147   0.874  1.00  0.00           C  
HETATM    7  C4  UNL     1       0.839  -1.131   0.617  1.00  0.00           C  
HETATM    8  N1  UNL     1       0.211   0.147   0.613  1.00  0.00           N  
HETATM    9  C5  UNL     1      -1.265   0.080   0.625  1.00  0.00           C  
HETATM   10  C6  UNL     1      -1.790  -0.577  -0.593  1.00  0.00           C  
HETATM   11  C7  UNL     1      -3.260  -0.714  -0.725  1.00  0.00           C  
HETATM   12  O4  UNL     1      -3.994   0.434  -0.756  1.00  0.00           O  
HETATM   13  C8  UNL     1      -1.750   1.449   0.888  1.00  0.00           C  
HETATM   14  O5  UNL     1      -0.887   2.382   0.909  1.00  0.00           O  
HETATM   15  O6  UNL     1      -3.034   1.840   1.120  1.00  0.00           O  
HETATM   16  H1  UNL     1       3.652   2.078  -1.774  1.00  0.00           H  
HETATM   17  H2  UNL     1       4.228  -0.418   0.376  1.00  0.00           H  
HETATM   18  H3  UNL     1       3.070  -0.234  -2.029  1.00  0.00           H  
HETATM   19  H4  UNL     1       2.678  -2.217   0.838  1.00  0.00           H  
HETATM   20  H5  UNL     1       2.501  -0.724   1.899  1.00  0.00           H  
HETATM   21  H6  UNL     1       0.339  -1.725   1.432  1.00  0.00           H  
HETATM   22  H7  UNL     1       0.612  -1.754  -0.302  1.00  0.00           H  
HETATM   23  H8  UNL     1       0.505   0.620  -0.294  1.00  0.00           H  
HETATM   24  H9  UNL     1      -1.491  -0.517   1.546  1.00  0.00           H  
HETATM   25  H10 UNL     1      -1.305  -1.568  -0.722  1.00  0.00           H  
HETATM   26  H11 UNL     1      -1.438   0.028  -1.475  1.00  0.00           H  
HETATM   27  H12 UNL     1      -3.443  -1.236  -1.712  1.00  0.00           H  
HETATM   28  H13 UNL     1      -3.715  -1.381   0.045  1.00  0.00           H  
HETATM   29  H14 UNL     1      -4.907   0.357  -1.076  1.00  0.00           H  
HETATM   30  H15 UNL     1      -3.455   2.704   0.884  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3    4
CONECT    3   16
CONECT    4    5    6   17
CONECT    5   18
CONECT    6    7   19   20
CONECT    7    8   21   22
CONECT    8    9   23
CONECT    9   10   13   24
CONECT   10   11   25   26
CONECT   11   12   27   28
CONECT   12   29
CONECT   13   14   14   15
CONECT   15   30
END