COMPND    HMDB0029467
HETATM    1  C1  UNL     1      -2.922   2.599   0.090  1.00  0.00           C  
HETATM    2  O1  UNL     1      -2.878   1.204   0.055  1.00  0.00           O  
HETATM    3  C2  UNL     1      -1.700   0.497  -0.047  1.00  0.00           C  
HETATM    4  C3  UNL     1      -0.501   1.168  -0.119  1.00  0.00           C  
HETATM    5  C4  UNL     1       0.704   0.467  -0.222  1.00  0.00           C  
HETATM    6  O2  UNL     1       1.861   1.077  -0.292  1.00  0.00           O  
HETATM    7  C5  UNL     1       2.993   0.406  -0.390  1.00  0.00           C  
HETATM    8  C6  UNL     1       4.278   1.164  -0.466  1.00  0.00           C  
HETATM    9  C7  UNL     1       3.014  -0.977  -0.422  1.00  0.00           C  
HETATM   10  C8  UNL     1       1.810  -1.625  -0.350  1.00  0.00           C  
HETATM   11  O3  UNL     1       1.774  -2.890  -0.376  1.00  0.00           O  
HETATM   12  C9  UNL     1       0.611  -0.912  -0.246  1.00  0.00           C  
HETATM   13  C10 UNL     1      -0.582  -1.589  -0.175  1.00  0.00           C  
HETATM   14  O4  UNL     1      -0.541  -2.982  -0.209  1.00  0.00           O  
HETATM   15  C11 UNL     1      -1.760  -0.892  -0.074  1.00  0.00           C  
HETATM   16  C12 UNL     1      -3.058  -1.612   0.004  1.00  0.00           C  
HETATM   17  H1  UNL     1      -2.278   3.073  -0.675  1.00  0.00           H  
HETATM   18  H2  UNL     1      -3.979   2.923  -0.136  1.00  0.00           H  
HETATM   19  H3  UNL     1      -2.637   2.967   1.118  1.00  0.00           H  
HETATM   20  H4  UNL     1      -0.426   2.235  -0.100  1.00  0.00           H  
HETATM   21  H5  UNL     1       5.125   0.454  -0.457  1.00  0.00           H  
HETATM   22  H6  UNL     1       4.307   1.750  -1.410  1.00  0.00           H  
HETATM   23  H7  UNL     1       4.418   1.817   0.427  1.00  0.00           H  
HETATM   24  H8  UNL     1       3.931  -1.545  -0.502  1.00  0.00           H  
HETATM   25  H9  UNL     1      -1.425  -3.488  -0.157  1.00  0.00           H  
HETATM   26  H10 UNL     1      -3.884  -0.878   0.119  1.00  0.00           H  
HETATM   27  H11 UNL     1      -3.204  -2.153  -0.948  1.00  0.00           H  
HETATM   28  H12 UNL     1      -3.052  -2.256   0.890  1.00  0.00           H  
CONECT    1    2   17   18   19
CONECT    2    3
CONECT    3    4    4   15
CONECT    4    5   20
CONECT    5    6   12   12
CONECT    6    7
CONECT    7    8    9    9
CONECT    8   21   22   23
CONECT    9   10   24
CONECT   10   11   11   12
CONECT   12   13
CONECT   13   14   15   15
CONECT   14   25
CONECT   15   16
CONECT   16   26   27   28
END