COMPND    HMDB0035132
HETATM    1  C1  UNL     1      -3.325  -2.794   0.633  1.00  0.00           C  
HETATM    2  C2  UNL     1      -2.570  -1.592   0.264  1.00  0.00           C  
HETATM    3  C3  UNL     1      -1.331  -1.287   0.767  1.00  0.00           C  
HETATM    4  C4  UNL     1      -0.657  -0.149   0.395  1.00  0.00           C  
HETATM    5  C5  UNL     1      -1.211   0.730  -0.504  1.00  0.00           C  
HETATM    6  C6  UNL     1      -2.474   0.449  -1.037  1.00  0.00           C  
HETATM    7  C7  UNL     1      -3.121  -0.705  -0.639  1.00  0.00           C  
HETATM    8  O1  UNL     1      -4.370  -0.947  -1.190  1.00  0.00           O  
HETATM    9  C8  UNL     1      -0.674   1.970  -1.022  1.00  0.00           C  
HETATM   10  C9  UNL     1      -1.098   3.168  -0.157  1.00  0.00           C  
HETATM   11  C10 UNL     1       0.765   2.052  -1.190  1.00  0.00           C  
HETATM   12  C11 UNL     1       1.737   1.513  -0.516  1.00  0.00           C  
HETATM   13  C12 UNL     1       1.754   0.643   0.639  1.00  0.00           C  
HETATM   14  C13 UNL     1       2.910  -0.351   0.435  1.00  0.00           C  
HETATM   15  C14 UNL     1       2.545  -1.190  -0.770  1.00  0.00           C  
HETATM   16  C15 UNL     1       3.181  -1.155   1.660  1.00  0.00           C  
HETATM   17  O2  UNL     1       4.008   0.440   0.082  1.00  0.00           O  
HETATM   18  O3  UNL     1       0.583   0.011   0.996  1.00  0.00           O  
HETATM   19  H1  UNL     1      -4.330  -2.519   1.038  1.00  0.00           H  
HETATM   20  H2  UNL     1      -2.794  -3.457   1.314  1.00  0.00           H  
HETATM   21  H3  UNL     1      -3.551  -3.388  -0.297  1.00  0.00           H  
HETATM   22  H4  UNL     1      -0.864  -1.950   1.474  1.00  0.00           H  
HETATM   23  H5  UNL     1      -2.918   1.138  -1.748  1.00  0.00           H  
HETATM   24  H6  UNL     1      -4.884  -1.778  -0.930  1.00  0.00           H  
HETATM   25  H7  UNL     1      -1.176   2.169  -2.014  1.00  0.00           H  
HETATM   26  H8  UNL     1      -0.450   4.011  -0.475  1.00  0.00           H  
HETATM   27  H9  UNL     1      -0.794   2.929   0.896  1.00  0.00           H  
HETATM   28  H10 UNL     1      -2.174   3.374  -0.256  1.00  0.00           H  
HETATM   29  H11 UNL     1       1.078   2.686  -2.042  1.00  0.00           H  
HETATM   30  H12 UNL     1       2.753   1.760  -0.883  1.00  0.00           H  
HETATM   31  H13 UNL     1       2.087   1.258   1.528  1.00  0.00           H  
HETATM   32  H14 UNL     1       2.271  -0.491  -1.589  1.00  0.00           H  
HETATM   33  H15 UNL     1       3.359  -1.834  -1.114  1.00  0.00           H  
HETATM   34  H16 UNL     1       1.615  -1.740  -0.513  1.00  0.00           H  
HETATM   35  H17 UNL     1       2.624  -0.797   2.561  1.00  0.00           H  
HETATM   36  H18 UNL     1       3.007  -2.227   1.448  1.00  0.00           H  
HETATM   37  H19 UNL     1       4.268  -1.032   1.942  1.00  0.00           H  
HETATM   38  H20 UNL     1       4.221   1.082   0.814  1.00  0.00           H  
CONECT    1    2   19   20   21
CONECT    2    3    3    7
CONECT    3    4   22
CONECT    4    5    5   18
CONECT    5    6    9
CONECT    6    7    7   23
CONECT    7    8
CONECT    8   24
CONECT    9   10   11   25
CONECT   10   26   27   28
CONECT   11   12   12   29
CONECT   12   13   30
CONECT   13   14   18   31
CONECT   14   15   16   17
CONECT   15   32   33   34
CONECT   16   35   36   37
CONECT   17   38
END