COMPND    HMDB0040549
HETATM    1  C1  UNL     1       4.725   1.078   0.008  1.00  0.00           C  
HETATM    2  C2  UNL     1       3.707   0.440   0.136  1.00  0.00           C  
HETATM    3  C3  UNL     1       2.509  -0.303   0.266  1.00  0.00           C  
HETATM    4  C4  UNL     1       1.462  -0.935   0.371  1.00  0.00           C  
HETATM    5  C5  UNL     1       0.271  -1.682   0.503  1.00  0.00           C  
HETATM    6  C6  UNL     1      -0.809  -1.134   0.015  1.00  0.00           C  
HETATM    7  C7  UNL     1      -1.873  -0.488  -0.402  1.00  0.00           C  
HETATM    8  C8  UNL     1      -2.521   0.373   0.574  1.00  0.00           C  
HETATM    9  O1  UNL     1      -2.132   1.699   0.534  1.00  0.00           O  
HETATM   10  H1  UNL     1       5.613   1.655  -0.104  1.00  0.00           H  
HETATM   11  H2  UNL     1       0.127  -2.625   0.943  1.00  0.00           H  
HETATM   12  H3  UNL     1      -2.113  -0.687  -1.408  1.00  0.00           H  
HETATM   13  H4  UNL     1      -3.632   0.331   0.376  1.00  0.00           H  
HETATM   14  H5  UNL     1      -2.423  -0.042   1.617  1.00  0.00           H  
HETATM   15  H6  UNL     1      -2.909   2.319   0.480  1.00  0.00           H  
CONECT    1    2    2    2   10
CONECT    2    3
CONECT    3    4    4    4
CONECT    4    5
CONECT    5    6    6   11
CONECT    6    7    7
CONECT    7    8   12
CONECT    8    9   13   14
CONECT    9   15
END