TDT2MOL 
CC=CC(=O)CS(=O)(=O)C
 20 19  0  0  0  0              0      
    3.4100    1.1400   -0.0500 C   0  0  0  3  0  0
    2.2700    0.3100   -0.5700 C   0  0  0  1  0  0
    1.2900   -0.0800    0.2700 C   0  0  0  1  0  0
    0.1500   -0.9200   -0.2300 C   0  0  0  0  0  0
    0.1000   -1.2600   -1.4300 O   0  0  0  0  0  0
   -0.9400   -1.3400    0.7100 C   0  0  0  2  0  0
   -2.5400   -0.8600    0.0500 S   0  0  0  0  0  0
   -3.5900   -1.2300    0.9800 O   0  0  0  0  0  0
   -2.7700   -1.5300   -1.2200 O   0  0  0  0  0  0
   -2.5800    0.9300   -0.2100 C   0  0  0  3  0  0
    4.3400    0.5600   -0.0900 H   0  0  0  0  0  0
    3.2100    1.4300    0.9900 H   0  0  0  0  0  0
    3.5100    2.0500   -0.6700 H   0  0  0  0  0  0
    2.2500    0.0100   -1.6300 H   0  0  0  0  0  0
    1.3200    0.2200    1.3300 H   0  0  0  0  0  0
   -0.7800   -0.8500    1.6900 H   0  0  0  0  0  0
   -0.9100   -2.4300    0.8400 H   0  0  0  0  0  0
   -3.5600    1.2200   -0.6000 H   0  0  0  0  0  0
   -1.7900    1.2100   -0.9300 H   0  0  0  0  0  0
   -2.4000    1.4400    0.7500 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  2  0
  7 10  1  0
 11  1  1  0
 12  1  1  0
 13  1  1  0
 14  2  1  0
 15  3  1  0
 16  6  1  0
 17  6  1  0
 18 10  1  0
 19 10  1  0
 20 10  1  0
M  END

$$$$