COMPND    HMDB0037723
HETATM    1  O1  UNL     1       0.403   0.921   0.665  1.00  0.00           O  
HETATM    2  C1  UNL     1       1.298   0.118   0.364  1.00  0.00           C  
HETATM    3  O2  UNL     1       1.137  -1.182   0.742  1.00  0.00           O  
HETATM    4  C2  UNL     1       0.051  -1.711   1.425  1.00  0.00           C  
HETATM    5  C3  UNL     1      -1.256  -1.796   0.779  1.00  0.00           C  
HETATM    6  C4  UNL     1      -1.948  -0.643   0.257  1.00  0.00           C  
HETATM    7  C5  UNL     1      -1.780  -0.394  -1.104  1.00  0.00           C  
HETATM    8  C6  UNL     1      -2.385   0.667  -1.727  1.00  0.00           C  
HETATM    9  C7  UNL     1      -3.183   1.514  -0.989  1.00  0.00           C  
HETATM   10  C8  UNL     1      -3.358   1.279   0.360  1.00  0.00           C  
HETATM   11  C9  UNL     1      -2.744   0.216   0.951  1.00  0.00           C  
HETATM   12  C10 UNL     1       2.487   0.590  -0.381  1.00  0.00           C  
HETATM   13  C11 UNL     1       3.507  -0.259  -0.739  1.00  0.00           C  
HETATM   14  C12 UNL     1       4.470   0.491  -1.425  1.00  0.00           C  
HETATM   15  C13 UNL     1       3.940   1.781  -1.430  1.00  0.00           C  
HETATM   16  O3  UNL     1       2.783   1.766  -0.804  1.00  0.00           O  
HETATM   17  H1  UNL     1       0.371  -2.801   1.594  1.00  0.00           H  
HETATM   18  H2  UNL     1       0.014  -1.370   2.501  1.00  0.00           H  
HETATM   19  H3  UNL     1      -1.193  -2.582  -0.043  1.00  0.00           H  
HETATM   20  H4  UNL     1      -2.005  -2.302   1.481  1.00  0.00           H  
HETATM   21  H5  UNL     1      -1.158  -1.036  -1.732  1.00  0.00           H  
HETATM   22  H6  UNL     1      -2.267   0.878  -2.786  1.00  0.00           H  
HETATM   23  H7  UNL     1      -3.668   2.359  -1.473  1.00  0.00           H  
HETATM   24  H8  UNL     1      -4.004   1.972   0.936  1.00  0.00           H  
HETATM   25  H9  UNL     1      -2.899   0.061   1.995  1.00  0.00           H  
HETATM   26  H10 UNL     1       3.576  -1.321  -0.538  1.00  0.00           H  
HETATM   27  H11 UNL     1       5.401   0.144  -1.848  1.00  0.00           H  
HETATM   28  H12 UNL     1       4.411   2.641  -1.876  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3   12
CONECT    3    4
CONECT    4    5   17   18
CONECT    5    6   19   20
CONECT    6    7    7   11
CONECT    7    8   21
CONECT    8    9    9   22
CONECT    9   10   23
CONECT   10   11   11   24
CONECT   11   25
CONECT   12   13   13   16
CONECT   13   14   26
CONECT   14   15   15   27
CONECT   15   16   28
END