COMPND    HMDB0032289
HETATM    1  C1  UNL     1       3.614  -0.419  -0.260  1.00  0.00           C  
HETATM    2  C2  UNL     1       2.249  -0.905   0.217  1.00  0.00           C  
HETATM    3  C3  UNL     1       1.287  -0.703  -0.960  1.00  0.00           C  
HETATM    4  S1  UNL     1       1.297   1.058  -1.331  1.00  0.00           S  
HETATM    5  S2  UNL     1       0.435   2.067   0.332  1.00  0.00           S  
HETATM    6  C4  UNL     1      -1.330   2.203   0.071  1.00  0.00           C  
HETATM    7  C5  UNL     1      -2.034   0.879   0.081  1.00  0.00           C  
HETATM    8  C6  UNL     1      -2.562   0.266   1.200  1.00  0.00           C  
HETATM    9  C7  UNL     1      -3.128  -0.931   0.814  1.00  0.00           C  
HETATM   10  C8  UNL     1      -2.916  -1.002  -0.561  1.00  0.00           C  
HETATM   11  O1  UNL     1      -2.282   0.073  -0.912  1.00  0.00           O  
HETATM   12  H1  UNL     1       4.175   0.062   0.581  1.00  0.00           H  
HETATM   13  H2  UNL     1       3.456   0.388  -1.011  1.00  0.00           H  
HETATM   14  H3  UNL     1       4.193  -1.222  -0.734  1.00  0.00           H  
HETATM   15  H4  UNL     1       2.289  -1.951   0.543  1.00  0.00           H  
HETATM   16  H5  UNL     1       1.962  -0.210   1.045  1.00  0.00           H  
HETATM   17  H6  UNL     1       0.282  -1.071  -0.722  1.00  0.00           H  
HETATM   18  H7  UNL     1       1.684  -1.330  -1.773  1.00  0.00           H  
HETATM   19  H8  UNL     1      -1.743   2.877   0.856  1.00  0.00           H  
HETATM   20  H9  UNL     1      -1.506   2.731  -0.899  1.00  0.00           H  
HETATM   21  H10 UNL     1      -2.535   0.657   2.204  1.00  0.00           H  
HETATM   22  H11 UNL     1      -3.635  -1.675   1.425  1.00  0.00           H  
HETATM   23  H12 UNL     1      -3.253  -1.841  -1.165  1.00  0.00           H  
CONECT    1    2   12   13   14
CONECT    2    3   15   16
CONECT    3    4   17   18
CONECT    4    5
CONECT    5    6
CONECT    6    7   19   20
CONECT    7    8    8   11
CONECT    8    9   21
CONECT    9   10   10   22
CONECT   10   11   23
END