COMPND    HMDB0251315
HETATM    1  O1  UNL     1      -2.028  -2.792   0.631  1.00  0.00           O  
HETATM    2  C1  UNL     1      -1.464  -1.681   0.460  1.00  0.00           C  
HETATM    3  C2  UNL     1      -2.312  -0.535   0.166  1.00  0.00           C  
HETATM    4  C3  UNL     1      -3.677  -0.581   0.465  1.00  0.00           C  
HETATM    5  C4  UNL     1      -4.423   0.534   0.164  1.00  0.00           C  
HETATM    6  C5  UNL     1      -3.879   1.661  -0.408  1.00  0.00           C  
HETATM    7  C6  UNL     1      -2.536   1.674  -0.690  1.00  0.00           C  
HETATM    8  C7  UNL     1      -1.735   0.576  -0.406  1.00  0.00           C  
HETATM    9  O2  UNL     1      -0.390   0.571  -0.680  1.00  0.00           O  
HETATM   10  C8  UNL     1       0.497  -0.514  -0.499  1.00  0.00           C  
HETATM   11  C9  UNL     1       1.844   0.020  -0.187  1.00  0.00           C  
HETATM   12  C10 UNL     1       2.388   1.090  -0.889  1.00  0.00           C  
HETATM   13  C11 UNL     1       3.637   1.606  -0.622  1.00  0.00           C  
HETATM   14  C12 UNL     1       4.370   1.030   0.385  1.00  0.00           C  
HETATM   15  C13 UNL     1       3.887  -0.030   1.114  1.00  0.00           C  
HETATM   16  C14 UNL     1       2.611  -0.526   0.811  1.00  0.00           C  
HETATM   17  C15 UNL     1       0.004  -1.485   0.543  1.00  0.00           C  
HETATM   18  O3  UNL     1       0.644  -2.709   0.370  1.00  0.00           O  
HETATM   19  H1  UNL     1      -4.068  -1.481   0.914  1.00  0.00           H  
HETATM   20  H2  UNL     1      -5.498   0.530   0.386  1.00  0.00           H  
HETATM   21  H3  UNL     1      -4.531   2.521  -0.626  1.00  0.00           H  
HETATM   22  H4  UNL     1      -2.057   2.530  -1.138  1.00  0.00           H  
HETATM   23  H5  UNL     1       0.554  -1.032  -1.492  1.00  0.00           H  
HETATM   24  H6  UNL     1       1.751   1.506  -1.683  1.00  0.00           H  
HETATM   25  H7  UNL     1       4.036   2.436  -1.181  1.00  0.00           H  
HETATM   26  H8  UNL     1       5.350   1.405   0.622  1.00  0.00           H  
HETATM   27  H9  UNL     1       4.479  -0.478   1.910  1.00  0.00           H  
HETATM   28  H10 UNL     1       2.244  -1.361   1.393  1.00  0.00           H  
HETATM   29  H11 UNL     1       0.241  -1.111   1.547  1.00  0.00           H  
HETATM   30  H12 UNL     1       0.061  -3.374  -0.079  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3   17
CONECT    3    4    4    8
CONECT    4    5   19
CONECT    5    6    6   20
CONECT    6    7   21
CONECT    7    8    8   22
CONECT    8    9
CONECT    9   10
CONECT   10   11   17   23
CONECT   11   12   12   16
CONECT   12   13   24
CONECT   13   14   14   25
CONECT   14   15   26
CONECT   15   16   16   27
CONECT   16   28
CONECT   17   18   29
CONECT   18   30
END