COMPND    HMDB0240710
HETATM    1  O1  UNL     1       2.828   1.779  -0.314  1.00  0.00           O  
HETATM    2  C1  UNL     1       3.625   0.845  -0.365  1.00  0.00           C  
HETATM    3  O2  UNL     1       4.997   1.280  -0.432  1.00  0.00           O  
HETATM    4  C2  UNL     1       3.465  -0.569  -0.372  1.00  0.00           C  
HETATM    5  C3  UNL     1       2.368  -1.207  -0.274  1.00  0.00           C  
HETATM    6  C4  UNL     1       1.046  -0.703  -0.116  1.00  0.00           C  
HETATM    7  C5  UNL     1       0.599   0.410   0.499  1.00  0.00           C  
HETATM    8  C6  UNL     1      -0.722   0.837   0.455  1.00  0.00           C  
HETATM    9  C7  UNL     1      -1.698   0.151  -0.225  1.00  0.00           C  
HETATM   10  O3  UNL     1      -3.023   0.524  -0.305  1.00  0.00           O  
HETATM   11  S1  UNL     1      -4.235   0.068   0.752  1.00  0.00           S  
HETATM   12  O4  UNL     1      -3.747  -0.397   2.081  1.00  0.00           O  
HETATM   13  O5  UNL     1      -5.062  -1.037   0.112  1.00  0.00           O  
HETATM   14  O6  UNL     1      -5.299   1.384   0.912  1.00  0.00           O  
HETATM   15  C8  UNL     1      -1.263  -0.995  -0.860  1.00  0.00           C  
HETATM   16  C9  UNL     1       0.030  -1.422  -0.824  1.00  0.00           C  
HETATM   17  H1  UNL     1       5.410   1.597   0.438  1.00  0.00           H  
HETATM   18  H2  UNL     1       4.433  -1.148  -0.479  1.00  0.00           H  
HETATM   19  H3  UNL     1       2.460  -2.334  -0.314  1.00  0.00           H  
HETATM   20  H4  UNL     1       1.299   0.968   1.145  1.00  0.00           H  
HETATM   21  H5  UNL     1      -0.998   1.744   0.974  1.00  0.00           H  
HETATM   22  H6  UNL     1      -4.845   2.156   1.317  1.00  0.00           H  
HETATM   23  H7  UNL     1      -1.993  -1.592  -1.420  1.00  0.00           H  
HETATM   24  H8  UNL     1       0.326  -2.339  -1.345  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3    4
CONECT    3   17
CONECT    4    5    5   18
CONECT    5    6   19
CONECT    6    7    7   16
CONECT    7    8   20
CONECT    8    9    9   21
CONECT    9   10   15
CONECT   10   11
CONECT   11   12   12   13   13
CONECT   11   14
CONECT   14   22
CONECT   15   16   16   23
CONECT   16   24
END