COMPND    HMDB0015145
HETATM    1  C1  UNL     1      -1.869   1.784   0.542  1.00  0.00           C  
HETATM    2  C2  UNL     1      -1.801   0.305   0.718  1.00  0.00           C  
HETATM    3  N1  UNL     1      -0.972  -0.364  -0.261  1.00  0.00           N1+
HETATM    4  C3  UNL     1      -1.358  -1.782  -0.219  1.00  0.00           C  
HETATM    5  C4  UNL     1      -1.276   0.128  -1.580  1.00  0.00           C  
HETATM    6  C5  UNL     1       0.398  -0.296   0.035  1.00  0.00           C  
HETATM    7  C6  UNL     1       0.845  -0.781   1.252  1.00  0.00           C  
HETATM    8  C7  UNL     1       2.180  -0.742   1.600  1.00  0.00           C  
HETATM    9  C8  UNL     1       3.078  -0.204   0.703  1.00  0.00           C  
HETATM   10  C9  UNL     1       2.687   0.296  -0.528  1.00  0.00           C  
HETATM   11  O1  UNL     1       3.605   0.839  -1.428  1.00  0.00           O  
HETATM   12  C10 UNL     1       1.342   0.231  -0.821  1.00  0.00           C  
HETATM   13  H1  UNL     1      -2.885   2.053   0.137  1.00  0.00           H  
HETATM   14  H2  UNL     1      -1.055   2.224  -0.035  1.00  0.00           H  
HETATM   15  H3  UNL     1      -1.812   2.239   1.573  1.00  0.00           H  
HETATM   16  H4  UNL     1      -1.453  -0.007   1.728  1.00  0.00           H  
HETATM   17  H5  UNL     1      -2.828  -0.152   0.618  1.00  0.00           H  
HETATM   18  H6  UNL     1      -1.348  -2.224  -1.232  1.00  0.00           H  
HETATM   19  H7  UNL     1      -0.673  -2.300   0.481  1.00  0.00           H  
HETATM   20  H8  UNL     1      -2.385  -1.889   0.203  1.00  0.00           H  
HETATM   21  H9  UNL     1      -0.954   1.148  -1.766  1.00  0.00           H  
HETATM   22  H10 UNL     1      -2.368   0.068  -1.746  1.00  0.00           H  
HETATM   23  H11 UNL     1      -0.747  -0.560  -2.300  1.00  0.00           H  
HETATM   24  H12 UNL     1       0.171  -1.213   1.987  1.00  0.00           H  
HETATM   25  H13 UNL     1       2.518  -1.123   2.551  1.00  0.00           H  
HETATM   26  H14 UNL     1       4.152  -0.148   0.930  1.00  0.00           H  
HETATM   27  H15 UNL     1       3.780   1.842  -1.345  1.00  0.00           H  
HETATM   28  H16 UNL     1       1.027   0.627  -1.798  1.00  0.00           H  
CONECT    1    2   13   14   15
CONECT    2    3   16   17
CONECT    3    4    5    6
CONECT    4   18   19   20
CONECT    5   21   22   23
CONECT    6    7    7   12
CONECT    7    8   24
CONECT    8    9    9   25
CONECT    9   10   26
CONECT   10   11   12   12
CONECT   11   27
CONECT   12   28
END