COMPND    HMDB0035145
HETATM    1  O1  UNL     1      -1.093   2.680  -2.013  1.00  0.00           O  
HETATM    2  C1  UNL     1      -0.662   1.968  -1.055  1.00  0.00           C  
HETATM    3  O2  UNL     1       0.522   2.070  -0.376  1.00  0.00           O  
HETATM    4  C2  UNL     1       0.606   1.105   0.594  1.00  0.00           C  
HETATM    5  C3  UNL     1       1.809   0.240   0.484  1.00  0.00           C  
HETATM    6  C4  UNL     1       2.412  -0.381  -0.567  1.00  0.00           C  
HETATM    7  C5  UNL     1       3.508  -1.102  -0.311  1.00  0.00           C  
HETATM    8  C6  UNL     1       3.943  -1.166   0.985  1.00  0.00           C  
HETATM    9  S1  UNL     1       2.779  -0.194   1.805  1.00  0.00           S  
HETATM   10  C7  UNL     1      -0.642   0.326   0.514  1.00  0.00           C  
HETATM   11  C8  UNL     1      -1.141  -0.762   1.218  1.00  0.00           C  
HETATM   12  C9  UNL     1      -2.376  -1.278   0.898  1.00  0.00           C  
HETATM   13  C10 UNL     1      -3.142  -0.748  -0.107  1.00  0.00           C  
HETATM   14  C11 UNL     1      -2.671   0.349  -0.838  1.00  0.00           C  
HETATM   15  O3  UNL     1      -3.452   0.877  -1.852  1.00  0.00           O  
HETATM   16  C12 UNL     1      -1.410   0.854  -0.490  1.00  0.00           C  
HETATM   17  H1  UNL     1       0.573   1.610   1.598  1.00  0.00           H  
HETATM   18  H2  UNL     1       1.981  -0.268  -1.583  1.00  0.00           H  
HETATM   19  H3  UNL     1       4.081  -1.651  -1.089  1.00  0.00           H  
HETATM   20  H4  UNL     1       4.820  -1.707   1.382  1.00  0.00           H  
HETATM   21  H5  UNL     1      -0.530  -1.173   2.009  1.00  0.00           H  
HETATM   22  H6  UNL     1      -2.703  -2.138   1.498  1.00  0.00           H  
HETATM   23  H7  UNL     1      -4.107  -1.173  -0.337  1.00  0.00           H  
HETATM   24  H8  UNL     1      -3.104   1.663  -2.368  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3   16
CONECT    3    4
CONECT    4    5   10   17
CONECT    5    6    6    9
CONECT    6    7   18
CONECT    7    8    8   19
CONECT    8    9   20
CONECT   10   11   11   16
CONECT   11   12   21
CONECT   12   13   13   22
CONECT   13   14   23
CONECT   14   15   16   16
CONECT   15   24
END