COMPND    HMDB0035682
HETATM    1  C1  UNL     1       3.937  -0.968   2.149  1.00  0.00           C  
HETATM    2  C2  UNL     1       3.238  -0.184   1.106  1.00  0.00           C  
HETATM    3  C3  UNL     1       1.924  -0.102   1.101  1.00  0.00           C  
HETATM    4  C4  UNL     1       1.192   0.656   0.096  1.00  0.00           C  
HETATM    5  O1  UNL     1       1.860   1.241  -0.783  1.00  0.00           O  
HETATM    6  C5  UNL     1      -0.293   0.757   0.078  1.00  0.00           C  
HETATM    7  C6  UNL     1      -0.736   1.618  -1.084  1.00  0.00           C  
HETATM    8  C7  UNL     1      -1.940   2.457  -0.772  1.00  0.00           C  
HETATM    9  C8  UNL     1      -1.074   0.787  -2.290  1.00  0.00           C  
HETATM   10  C9  UNL     1      -1.824  -0.296  -2.085  1.00  0.00           C  
HETATM   11  C10 UNL     1      -2.241  -0.557  -0.684  1.00  0.00           C  
HETATM   12  C11 UNL     1      -0.969  -0.583   0.145  1.00  0.00           C  
HETATM   13  C12 UNL     1      -0.109  -1.680  -0.463  1.00  0.00           C  
HETATM   14  C13 UNL     1      -1.241  -0.911   1.587  1.00  0.00           C  
HETATM   15  H1  UNL     1       4.883  -0.445   2.385  1.00  0.00           H  
HETATM   16  H2  UNL     1       4.227  -1.975   1.756  1.00  0.00           H  
HETATM   17  H3  UNL     1       3.353  -1.032   3.084  1.00  0.00           H  
HETATM   18  H4  UNL     1       3.796   0.334   0.330  1.00  0.00           H  
HETATM   19  H5  UNL     1       1.400  -0.636   1.897  1.00  0.00           H  
HETATM   20  H6  UNL     1      -0.568   1.322   1.001  1.00  0.00           H  
HETATM   21  H7  UNL     1       0.100   2.304  -1.356  1.00  0.00           H  
HETATM   22  H8  UNL     1      -2.296   2.355   0.274  1.00  0.00           H  
HETATM   23  H9  UNL     1      -1.729   3.551  -0.918  1.00  0.00           H  
HETATM   24  H10 UNL     1      -2.811   2.245  -1.430  1.00  0.00           H  
HETATM   25  H11 UNL     1      -0.714   1.074  -3.268  1.00  0.00           H  
HETATM   26  H12 UNL     1      -2.078  -0.905  -2.930  1.00  0.00           H  
HETATM   27  H13 UNL     1      -2.996   0.134  -0.305  1.00  0.00           H  
HETATM   28  H14 UNL     1      -2.666  -1.594  -0.653  1.00  0.00           H  
HETATM   29  H15 UNL     1      -0.767  -2.461  -0.898  1.00  0.00           H  
HETATM   30  H16 UNL     1       0.506  -2.196   0.309  1.00  0.00           H  
HETATM   31  H17 UNL     1       0.536  -1.319  -1.272  1.00  0.00           H  
HETATM   32  H18 UNL     1      -2.324  -1.052   1.790  1.00  0.00           H  
HETATM   33  H19 UNL     1      -0.902  -0.112   2.289  1.00  0.00           H  
HETATM   34  H20 UNL     1      -0.675  -1.825   1.852  1.00  0.00           H  
CONECT    1    2   15   16   17
CONECT    2    3    3   18
CONECT    3    4   19
CONECT    4    5    5    6
CONECT    6    7   12   20
CONECT    7    8    9   21
CONECT    8   22   23   24
CONECT    9   10   10   25
CONECT   10   11   26
CONECT   11   12   27   28
CONECT   12   13   14
CONECT   13   29   30   31
CONECT   14   32   33   34
END