COMPND    HMDB0037007
HETATM    1  C1  UNL     1       3.204   0.913  -0.799  1.00  0.00           C  
HETATM    2  C2  UNL     1       2.131   0.047  -0.237  1.00  0.00           C  
HETATM    3  C3  UNL     1       1.643   0.214   0.996  1.00  0.00           C  
HETATM    4  C4  UNL     1       0.579  -0.711   1.443  1.00  0.00           C  
HETATM    5  C5  UNL     1      -0.521  -0.876   0.421  1.00  0.00           C  
HETATM    6  C6  UNL     1      -1.622   0.090   0.711  1.00  0.00           C  
HETATM    7  C7  UNL     1      -1.244   1.524   0.672  1.00  0.00           C  
HETATM    8  C8  UNL     1      -2.843  -0.123  -0.151  1.00  0.00           C  
HETATM    9  O1  UNL     1      -2.594   0.005  -1.511  1.00  0.00           O  
HETATM   10  C9  UNL     1      -0.025  -0.911  -0.980  1.00  0.00           C  
HETATM   11  C10 UNL     1       1.511  -1.070  -1.008  1.00  0.00           C  
HETATM   12  H1  UNL     1       4.173   0.437  -0.551  1.00  0.00           H  
HETATM   13  H2  UNL     1       3.072   0.992  -1.905  1.00  0.00           H  
HETATM   14  H3  UNL     1       3.118   1.918  -0.316  1.00  0.00           H  
HETATM   15  H4  UNL     1       2.046   1.018   1.613  1.00  0.00           H  
HETATM   16  H5  UNL     1       1.082  -1.697   1.636  1.00  0.00           H  
HETATM   17  H6  UNL     1       0.108  -0.374   2.399  1.00  0.00           H  
HETATM   18  H7  UNL     1      -0.946  -1.906   0.627  1.00  0.00           H  
HETATM   19  H8  UNL     1      -1.980  -0.120   1.771  1.00  0.00           H  
HETATM   20  H9  UNL     1      -2.044   2.106   1.203  1.00  0.00           H  
HETATM   21  H10 UNL     1      -1.215   1.932  -0.358  1.00  0.00           H  
HETATM   22  H11 UNL     1      -0.304   1.775   1.178  1.00  0.00           H  
HETATM   23  H12 UNL     1      -3.678   0.544   0.133  1.00  0.00           H  
HETATM   24  H13 UNL     1      -3.176  -1.180  -0.003  1.00  0.00           H  
HETATM   25  H14 UNL     1      -3.375   0.329  -1.999  1.00  0.00           H  
HETATM   26  H15 UNL     1      -0.296   0.019  -1.561  1.00  0.00           H  
HETATM   27  H16 UNL     1      -0.402  -1.758  -1.588  1.00  0.00           H  
HETATM   28  H17 UNL     1       1.861  -1.130  -2.035  1.00  0.00           H  
HETATM   29  H18 UNL     1       1.737  -2.007  -0.463  1.00  0.00           H  
CONECT    1    2   12   13   14
CONECT    2    3    3   11
CONECT    3    4   15
CONECT    4    5   16   17
CONECT    5    6   10   18
CONECT    6    7    8   19
CONECT    7   20   21   22
CONECT    8    9   23   24
CONECT    9   25
CONECT   10   11   26   27
CONECT   11   28   29
END