COMPND    HMDB0059829
HETATM    1  C1  UNL     1      -2.890  -0.844  -0.372  1.00  0.00           C  
HETATM    2  C2  UNL     1      -1.886   0.168   0.088  1.00  0.00           C  
HETATM    3  C3  UNL     1      -2.486   0.998   1.225  1.00  0.00           C  
HETATM    4  C4  UNL     1      -0.623  -0.473   0.586  1.00  0.00           C  
HETATM    5  C5  UNL     1      -0.362  -1.388   1.483  1.00  0.00           C  
HETATM    6  C6  UNL     1       1.009  -1.786   1.744  1.00  0.00           C  
HETATM    7  C7  UNL     1       2.000  -1.212   1.087  1.00  0.00           C  
HETATM    8  C8  UNL     1       1.831  -0.154   0.074  1.00  0.00           C  
HETATM    9  C9  UNL     1       2.462   1.102   0.642  1.00  0.00           C  
HETATM   10  C10 UNL     1       2.640  -0.539  -1.149  1.00  0.00           C  
HETATM   11  C11 UNL     1       0.448   0.058  -0.278  1.00  0.00           C  
HETATM   12  C12 UNL     1       0.111  -0.457  -1.669  1.00  0.00           C  
HETATM   13  C13 UNL     1      -0.922   0.244  -2.094  1.00  0.00           C  
HETATM   14  C14 UNL     1      -1.408   1.098  -0.961  1.00  0.00           C  
HETATM   15  C15 UNL     1      -0.029   1.501  -0.423  1.00  0.00           C  
HETATM   16  H1  UNL     1      -2.409  -1.821  -0.657  1.00  0.00           H  
HETATM   17  H2  UNL     1      -3.591  -1.066   0.485  1.00  0.00           H  
HETATM   18  H3  UNL     1      -3.496  -0.441  -1.181  1.00  0.00           H  
HETATM   19  H4  UNL     1      -3.406   0.519   1.580  1.00  0.00           H  
HETATM   20  H5  UNL     1      -1.736   1.105   2.033  1.00  0.00           H  
HETATM   21  H6  UNL     1      -2.713   2.040   0.881  1.00  0.00           H  
HETATM   22  H7  UNL     1      -1.160  -1.873   2.053  1.00  0.00           H  
HETATM   23  H8  UNL     1       1.238  -2.559   2.483  1.00  0.00           H  
HETATM   24  H9  UNL     1       3.035  -1.529   1.292  1.00  0.00           H  
HETATM   25  H10 UNL     1       2.644   1.865  -0.119  1.00  0.00           H  
HETATM   26  H11 UNL     1       3.457   0.796   1.053  1.00  0.00           H  
HETATM   27  H12 UNL     1       1.892   1.485   1.524  1.00  0.00           H  
HETATM   28  H13 UNL     1       2.477  -1.566  -1.476  1.00  0.00           H  
HETATM   29  H14 UNL     1       3.719  -0.462  -0.829  1.00  0.00           H  
HETATM   30  H15 UNL     1       2.503   0.225  -1.947  1.00  0.00           H  
HETATM   31  H16 UNL     1       0.605  -1.240  -2.219  1.00  0.00           H  
HETATM   32  H17 UNL     1      -1.377   0.240  -3.077  1.00  0.00           H  
HETATM   33  H18 UNL     1      -2.029   1.916  -1.242  1.00  0.00           H  
HETATM   34  H19 UNL     1       0.565   2.036  -1.168  1.00  0.00           H  
HETATM   35  H20 UNL     1      -0.111   2.012   0.548  1.00  0.00           H  
CONECT    1    2   16   17   18
CONECT    2    3    4   14
CONECT    3   19   20   21
CONECT    4    5    5   11
CONECT    5    6   22
CONECT    6    7    7   23
CONECT    7    8   24
CONECT    8    9   10   11
CONECT    9   25   26   27
CONECT   10   28   29   30
CONECT   11   12   15
CONECT   12   13   13   31
CONECT   13   14   32
CONECT   14   15   33
CONECT   15   34   35
END