COMPND    HMDB0041665
HETATM    1  C1  UNL     1       4.286   0.313  -0.885  1.00  0.00           C  
HETATM    2  O1  UNL     1       3.343   0.908  -0.013  1.00  0.00           O  
HETATM    3  C2  UNL     1       2.055   0.413   0.117  1.00  0.00           C  
HETATM    4  C3  UNL     1       1.704  -0.690  -0.635  1.00  0.00           C  
HETATM    5  C4  UNL     1       0.427  -1.184  -0.509  1.00  0.00           C  
HETATM    6  C5  UNL     1      -0.522  -0.619   0.340  1.00  0.00           C  
HETATM    7  C6  UNL     1      -1.863  -1.203   0.445  1.00  0.00           C  
HETATM    8  C7  UNL     1      -2.824  -0.699  -0.577  1.00  0.00           C  
HETATM    9  O2  UNL     1      -4.094  -1.298  -0.416  1.00  0.00           O  
HETATM   10  C8  UNL     1      -2.965   0.752  -0.463  1.00  0.00           C  
HETATM   11  O3  UNL     1      -4.063   1.250  -0.162  1.00  0.00           O  
HETATM   12  O4  UNL     1      -1.887   1.568  -0.688  1.00  0.00           O  
HETATM   13  C9  UNL     1      -0.111   0.492   1.073  1.00  0.00           C  
HETATM   14  C10 UNL     1       1.160   1.016   0.975  1.00  0.00           C  
HETATM   15  O5  UNL     1       1.534   2.129   1.724  1.00  0.00           O  
HETATM   16  H1  UNL     1       4.471  -0.752  -0.649  1.00  0.00           H  
HETATM   17  H2  UNL     1       3.869   0.411  -1.914  1.00  0.00           H  
HETATM   18  H3  UNL     1       5.248   0.858  -0.785  1.00  0.00           H  
HETATM   19  H4  UNL     1       2.431  -1.160  -1.316  1.00  0.00           H  
HETATM   20  H5  UNL     1       0.127  -2.051  -1.090  1.00  0.00           H  
HETATM   21  H6  UNL     1      -2.213  -0.999   1.500  1.00  0.00           H  
HETATM   22  H7  UNL     1      -1.817  -2.331   0.410  1.00  0.00           H  
HETATM   23  H8  UNL     1      -2.449  -1.024  -1.583  1.00  0.00           H  
HETATM   24  H9  UNL     1      -4.038  -2.185  -0.836  1.00  0.00           H  
HETATM   25  H10 UNL     1      -1.850   2.556  -0.611  1.00  0.00           H  
HETATM   26  H11 UNL     1      -0.852   0.944   1.752  1.00  0.00           H  
HETATM   27  H12 UNL     1       0.894   2.587   2.360  1.00  0.00           H  
CONECT    1    2   16   17   18
CONECT    2    3
CONECT    3    4    4   14
CONECT    4    5   19
CONECT    5    6    6   20
CONECT    6    7   13
CONECT    7    8   21   22
CONECT    8    9   10   23
CONECT    9   24
CONECT   10   11   11   12
CONECT   12   25
CONECT   13   14   14   26
CONECT   14   15
CONECT   15   27
END