HMDB0304930
     RDKit          3D

 22 22  0  0  0  0  0  0  0  0999 V2000
   -2.7385    1.8504    0.4636 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6261    0.3976    0.1345 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6956   -0.2647    0.1961 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3641   -0.2220   -0.2351 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3433   -1.5671   -0.5247 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1594   -2.2179   -0.8861 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9945   -1.4838   -0.9477 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0145   -0.1357   -0.6652 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2167    0.5192   -0.7527 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3250    0.7095    0.4966 S   0  0  0  0  0  6  0  0  0  0  0  0
    3.1496    1.9638    1.2702 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7034    0.7370   -0.1134 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2961   -0.5891    1.5659 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1744    0.4617   -0.3142 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6214    2.0406    1.5434 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9651    2.4312   -0.1161 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7113    2.2135    0.0712 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2288   -2.1625   -0.4842 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1850   -3.2743   -1.1056 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9006   -2.0201   -1.2324 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3581   -0.9006    1.7323 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1454    1.5134   -0.0962 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  2  4  1  0
  4  5  2  0
  5  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  2  0
 10 12  2  0
 10 13  1  0
  8 14  2  0
 14  4  1  0
  1 15  1  0
  1 16  1  0
  1 17  1  0
  5 18  1  0
  6 19  1  0
  7 20  1  0
 13 21  1  0
 14 22  1  0
M  END