COMPND    HMDB0240715
HETATM    1  O1  UNL     1       0.602  -0.617  -2.363  1.00  0.00           O  
HETATM    2  C1  UNL     1       0.409  -0.337  -1.125  1.00  0.00           C  
HETATM    3  C2  UNL     1       1.618  -0.107  -0.372  1.00  0.00           C  
HETATM    4  C3  UNL     1       1.694  -0.437   0.951  1.00  0.00           C  
HETATM    5  C4  UNL     1       2.864  -0.140   1.630  1.00  0.00           C  
HETATM    6  C5  UNL     1       3.937   0.468   1.014  1.00  0.00           C  
HETATM    7  C6  UNL     1       3.834   0.788  -0.324  1.00  0.00           C  
HETATM    8  C7  UNL     1       2.690   0.508  -1.017  1.00  0.00           C  
HETATM    9  C8  UNL     1      -0.929  -0.266  -0.567  1.00  0.00           C  
HETATM   10  C9  UNL     1      -1.164   0.420   0.626  1.00  0.00           C  
HETATM   11  C10 UNL     1      -2.408   0.590   1.182  1.00  0.00           C  
HETATM   12  C11 UNL     1      -3.512   0.068   0.553  1.00  0.00           C  
HETATM   13  O2  UNL     1      -4.800   0.231   1.105  1.00  0.00           O  
HETATM   14  C12 UNL     1      -3.322  -0.609  -0.620  1.00  0.00           C  
HETATM   15  C13 UNL     1      -2.039  -0.780  -1.184  1.00  0.00           C  
HETATM   16  O3  UNL     1      -1.929  -1.478  -2.365  1.00  0.00           O  
HETATM   17  H1  UNL     1       0.934  -0.937   1.530  1.00  0.00           H  
HETATM   18  H2  UNL     1       2.962  -0.386   2.681  1.00  0.00           H  
HETATM   19  H3  UNL     1       4.847   0.694   1.563  1.00  0.00           H  
HETATM   20  H4  UNL     1       4.665   1.272  -0.848  1.00  0.00           H  
HETATM   21  H5  UNL     1       2.627   0.766  -2.072  1.00  0.00           H  
HETATM   22  H6  UNL     1      -0.316   0.881   1.144  1.00  0.00           H  
HETATM   23  H7  UNL     1      -2.570   1.127   2.114  1.00  0.00           H  
HETATM   24  H8  UNL     1      -5.340   1.045   0.842  1.00  0.00           H  
HETATM   25  H9  UNL     1      -4.163  -1.034  -1.150  1.00  0.00           H  
HETATM   26  H10 UNL     1      -1.192  -1.730  -2.928  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3    9
CONECT    3    4    4    8
CONECT    4    5   17
CONECT    5    6    6   18
CONECT    6    7   19
CONECT    7    8    8   20
CONECT    8   21
CONECT    9   10   10   15
CONECT   10   11   22
CONECT   11   12   12   23
CONECT   12   13   14
CONECT   13   24
CONECT   14   15   15   25
CONECT   15   16
CONECT   16   26
END