COMPND    HMDB0032621
HETATM    1  C1  UNL     1       2.915   0.310  -0.543  1.00  0.00           C  
HETATM    2  O1  UNL     1       2.045  -0.732  -0.732  1.00  0.00           O  
HETATM    3  C2  UNL     1       1.489  -1.274   0.386  1.00  0.00           C  
HETATM    4  C3  UNL     1       0.592  -0.410   1.202  1.00  0.00           C  
HETATM    5  C4  UNL     1      -0.592   0.003   0.427  1.00  0.00           C  
HETATM    6  C5  UNL     1      -0.603   1.180  -0.269  1.00  0.00           C  
HETATM    7  C6  UNL     1      -1.717   1.545  -0.995  1.00  0.00           C  
HETATM    8  C7  UNL     1      -2.827   0.733  -1.029  1.00  0.00           C  
HETATM    9  C8  UNL     1      -2.853  -0.458  -0.341  1.00  0.00           C  
HETATM   10  C9  UNL     1      -1.738  -0.814   0.380  1.00  0.00           C  
HETATM   11  H1  UNL     1       3.276   0.666  -1.540  1.00  0.00           H  
HETATM   12  H2  UNL     1       2.419   1.140  -0.023  1.00  0.00           H  
HETATM   13  H3  UNL     1       3.844   0.001   0.001  1.00  0.00           H  
HETATM   14  H4  UNL     1       2.236  -1.773   1.058  1.00  0.00           H  
HETATM   15  H5  UNL     1       0.848  -2.138   0.035  1.00  0.00           H  
HETATM   16  H6  UNL     1       0.225  -1.023   2.053  1.00  0.00           H  
HETATM   17  H7  UNL     1       1.100   0.483   1.623  1.00  0.00           H  
HETATM   18  H8  UNL     1       0.228   1.844  -0.268  1.00  0.00           H  
HETATM   19  H9  UNL     1      -1.744   2.487  -1.560  1.00  0.00           H  
HETATM   20  H10 UNL     1      -3.708   1.048  -1.619  1.00  0.00           H  
HETATM   21  H11 UNL     1      -3.737  -1.078  -0.384  1.00  0.00           H  
HETATM   22  H12 UNL     1      -1.698  -1.740   0.942  1.00  0.00           H  
CONECT    1    2   11   12   13
CONECT    2    3
CONECT    3    4   14   15
CONECT    4    5   16   17
CONECT    5    6    6   10
CONECT    6    7   18
CONECT    7    8    8   19
CONECT    8    9   20
CONECT    9   10   10   21
CONECT   10   22
END