TDT2MOL 
CC=CC(=O)CS(=O)C
 19 18  0  0  0  0              0      
   -3.6700    0.2500    0.1100 C   0  0  0  3  0  0
   -2.1900    0.0900    0.2600 C   0  0  0  1  0  0
   -1.4000    0.0500   -0.8300 C   0  0  0  1  0  0
    0.0800   -0.1200   -0.6900 C   0  0  0  0  0  0
    0.8000   -0.1500   -1.7200 O   0  0  0  0  0  0
    0.7100   -0.2500    0.6600 C   0  0  0  2  0  0
    2.4300   -0.7600    0.4700 S   0  0  0  0  0  0
    2.8300   -2.1000    0.8600 O   0  0  0  0  0  0
    3.6400    0.3900   -0.2000 C   0  0  0  3  0  0
   -4.1500    0.2300    1.1100 H   0  0  0  0  0  0
   -3.8900    1.2100   -0.3800 H   0  0  0  0  0  0
   -4.0700   -0.5700   -0.5000 H   0  0  0  0  0  0
   -1.7500   -0.0100    1.2600 H   0  0  0  0  0  0
   -1.8500    0.1400   -1.8300 H   0  0  0  0  0  0
    0.1700   -1.0100    1.2500 H   0  0  0  0  0  0
    0.6700    0.7200    1.1800 H   0  0  0  0  0  0
    3.4300    0.5600   -1.2700 H   0  0  0  0  0  0
    3.5800    1.3400    0.3400 H   0  0  0  0  0  0
    4.6500   -0.0400   -0.0900 H   0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  3  4  1  0
  4  5  2  0
  4  6  1  0
  6  7  1  0
  7  8  2  0
  7  9  1  0
 10  1  1  0
 11  1  1  0
 12  1  1  0
 13  2  1  0
 14  3  1  0
 15  6  1  0
 16  6  1  0
 17  9  1  0
 18  9  1  0
 19  9  1  0
M  END

$$$$