COMPND    HMDB0244909
HETATM    1  O1  UNL     1       1.043  -0.789   2.197  1.00  0.00           O  
HETATM    2  C1  UNL     1       1.472  -1.513   1.282  1.00  0.00           C  
HETATM    3  O2  UNL     1       1.700  -2.850   1.523  1.00  0.00           O  
HETATM    4  C2  UNL     1       1.736  -0.962  -0.048  1.00  0.00           C  
HETATM    5  C3  UNL     1       1.443   0.483  -0.145  1.00  0.00           C  
HETATM    6  C4  UNL     1       2.498   1.421  -0.138  1.00  0.00           C  
HETATM    7  C5  UNL     1       2.206   2.762  -0.196  1.00  0.00           C  
HETATM    8  C6  UNL     1       0.907   3.219  -0.262  1.00  0.00           C  
HETATM    9  C7  UNL     1      -0.097   2.277  -0.268  1.00  0.00           C  
HETATM   10  C8  UNL     1       0.151   0.908  -0.211  1.00  0.00           C  
HETATM   11  C9  UNL     1      -0.983   0.002  -0.258  1.00  0.00           C  
HETATM   12  C10 UNL     1      -1.912   0.060   0.789  1.00  0.00           C  
HETATM   13  C11 UNL     1      -3.022  -0.736   0.805  1.00  0.00           C  
HETATM   14  C12 UNL     1      -3.236  -1.613  -0.224  1.00  0.00           C  
HETATM   15  C13 UNL     1      -2.346  -1.699  -1.272  1.00  0.00           C  
HETATM   16  C14 UNL     1      -1.223  -0.885  -1.278  1.00  0.00           C  
HETATM   17  H1  UNL     1       2.038  -3.475   0.796  1.00  0.00           H  
HETATM   18  H2  UNL     1       2.863  -1.056  -0.193  1.00  0.00           H  
HETATM   19  H3  UNL     1       1.267  -1.510  -0.856  1.00  0.00           H  
HETATM   20  H4  UNL     1       3.515   1.058  -0.086  1.00  0.00           H  
HETATM   21  H5  UNL     1       3.032   3.481  -0.189  1.00  0.00           H  
HETATM   22  H6  UNL     1       0.658   4.249  -0.307  1.00  0.00           H  
HETATM   23  H7  UNL     1      -1.122   2.602  -0.318  1.00  0.00           H  
HETATM   24  H8  UNL     1      -1.711   0.761   1.580  1.00  0.00           H  
HETATM   25  H9  UNL     1      -3.698  -0.628   1.662  1.00  0.00           H  
HETATM   26  H10 UNL     1      -4.132  -2.230  -0.172  1.00  0.00           H  
HETATM   27  H11 UNL     1      -2.507  -2.390  -2.093  1.00  0.00           H  
HETATM   28  H12 UNL     1      -0.541  -0.948  -2.120  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3    4
CONECT    3   17
CONECT    4    5   18   19
CONECT    5    6    6   10
CONECT    6    7   20
CONECT    7    8    8   21
CONECT    8    9   22
CONECT    9   10   10   23
CONECT   10   11
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
END