COMPND    HMDB0030756
HETATM    1  O1  UNL     1      -0.419   0.683   2.135  1.00  0.00           O  
HETATM    2  C1  UNL     1      -0.586   0.647   0.885  1.00  0.00           C  
HETATM    3  C2  UNL     1      -1.925   0.295   0.445  1.00  0.00           C  
HETATM    4  C3  UNL     1      -2.919  -0.113   1.322  1.00  0.00           C  
HETATM    5  C4  UNL     1      -4.190  -0.447   0.907  1.00  0.00           C  
HETATM    6  C5  UNL     1      -5.363  -0.874   1.496  1.00  0.00           C  
HETATM    7  C6  UNL     1      -6.317  -1.042   0.511  1.00  0.00           C  
HETATM    8  O2  UNL     1      -5.746  -0.731  -0.627  1.00  0.00           O  
HETATM    9  C7  UNL     1      -4.489  -0.373  -0.440  1.00  0.00           C  
HETATM   10  C8  UNL     1      -3.507   0.032  -1.327  1.00  0.00           C  
HETATM   11  C9  UNL     1      -2.239   0.363  -0.894  1.00  0.00           C  
HETATM   12  O3  UNL     1      -1.241   0.776  -1.809  1.00  0.00           O  
HETATM   13  C10 UNL     1       0.121   0.524  -1.511  1.00  0.00           C  
HETATM   14  C11 UNL     1       1.017   1.362  -2.399  1.00  0.00           C  
HETATM   15  O4  UNL     1       2.305   1.562  -1.824  1.00  0.00           O  
HETATM   16  C12 UNL     1       2.761   0.753  -0.762  1.00  0.00           C  
HETATM   17  C13 UNL     1       4.053   0.327  -0.640  1.00  0.00           C  
HETATM   18  C14 UNL     1       4.404  -0.463   0.435  1.00  0.00           C  
HETATM   19  C15 UNL     1       3.481  -0.831   1.386  1.00  0.00           C  
HETATM   20  C16 UNL     1       2.171  -0.386   1.241  1.00  0.00           C  
HETATM   21  C17 UNL     1       1.794   0.401   0.182  1.00  0.00           C  
HETATM   22  C18 UNL     1       0.457   0.930  -0.081  1.00  0.00           C  
HETATM   23  O5  UNL     1       0.591   2.345  -0.137  1.00  0.00           O  
HETATM   24  O6  UNL     1       4.104  -1.625   2.355  1.00  0.00           O  
HETATM   25  C19 UNL     1       5.476  -1.770   2.007  1.00  0.00           C  
HETATM   26  O7  UNL     1       5.610  -1.034   0.818  1.00  0.00           O  
HETATM   27  H1  UNL     1      -2.693  -0.172   2.369  1.00  0.00           H  
HETATM   28  H2  UNL     1      -5.496  -1.043   2.555  1.00  0.00           H  
HETATM   29  H3  UNL     1      -7.346  -1.364   0.598  1.00  0.00           H  
HETATM   30  H4  UNL     1      -3.719   0.098  -2.395  1.00  0.00           H  
HETATM   31  H5  UNL     1       0.379  -0.549  -1.601  1.00  0.00           H  
HETATM   32  H6  UNL     1       1.130   0.872  -3.400  1.00  0.00           H  
HETATM   33  H7  UNL     1       0.559   2.358  -2.576  1.00  0.00           H  
HETATM   34  H8  UNL     1       4.786   0.624  -1.402  1.00  0.00           H  
HETATM   35  H9  UNL     1       1.436  -0.674   1.986  1.00  0.00           H  
HETATM   36  H10 UNL     1      -0.307   2.734   0.024  1.00  0.00           H  
HETATM   37  H11 UNL     1       6.145  -1.354   2.791  1.00  0.00           H  
HETATM   38  H12 UNL     1       5.721  -2.842   1.779  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3   22
CONECT    3    4    4   11
CONECT    4    5   27
CONECT    5    6    9    9
CONECT    6    7    7   28
CONECT    7    8   29
CONECT    8    9
CONECT    9   10
CONECT   10   11   11   30
CONECT   11   12
CONECT   12   13
CONECT   13   14   22   31
CONECT   14   15   32   33
CONECT   15   16
CONECT   16   17   17   21
CONECT   17   18   34
CONECT   18   19   19   26
CONECT   19   20   24
CONECT   20   21   21   35
CONECT   21   22
CONECT   22   23
CONECT   23   36
CONECT   24   25
CONECT   25   26   37   38
END