TDT2MOL 
CC(=C=CC(C)(C)C(=O)CC(=C)C)C
 34 33  0  0  0  0              0      
    3.4500   -1.6200    0.0100 C   0  0  0  3  0  0
    3.1100   -0.2800   -0.5800 C   0  0  0  0  0  0
    1.8200    0.0700   -0.7400 C   0  0  0  0  0  0
    0.5300    0.4400   -0.9100 C   0  0  0  1  0  0
   -0.2100    1.1200    0.2000 C   0  0  0  0  0  0
   -1.0900    2.2000   -0.3700 C   0  0  0  3  0  0
    0.7700    1.7300    1.1600 C   0  0  0  3  0  0
   -1.0600    0.1100    0.9200 C   0  0  0  0  0  0
   -1.4400    0.3300    2.0900 O   0  0  0  0  0  0
   -1.4400   -1.1700    0.2300 C   0  0  0  2  0  0
   -2.9400   -1.3200    0.2800 C   0  0  0  0  0  0
   -3.5200   -1.8800    1.3500 C   0  0  0  2  0  0
   -3.7700   -0.8600   -0.8800 C   0  0  0  3  0  0
    4.2000    0.6700   -0.9500 C   0  0  0  3  0  0
    4.3900   -1.5500    0.5600 H   0  0  0  0  0  0
    2.6500   -1.9400    0.6900 H   0  0  0  0  0  0
    3.5600   -2.3600   -0.8000 H   0  0  0  0  0  0
    0.0100    0.2000   -1.8500 H   0  0  0  0  0  0
   -1.8100    1.7500   -1.0700 H   0  0  0  0  0  0
   -0.4700    2.9300   -0.9000 H   0  0  0  0  0  0
   -1.6300    2.7000    0.4500 H   0  0  0  0  0  0
    0.2200    2.2300    1.9800 H   0  0  0  0  0  0
    1.3900    2.4700    0.6300 H   0  0  0  0  0  0
    1.4100    0.9400    1.5800 H   0  0  0  0  0  0
   -1.1100   -1.1300   -0.8100 H   0  0  0  0  0  0
   -0.9700   -2.0200    0.7500 H   0  0  0  0  0  0
   -4.6200   -2.0000    1.3900 H   0  0  0  0  0  0
   -2.9100   -2.2200    2.2000 H   0  0  0  0  0  0
   -4.6600   -1.5000   -0.9700 H   0  0  0  0  0  0
   -4.0900    0.1800   -0.7100 H   0  0  0  0  0  0
   -3.1800   -0.9100   -1.8000 H   0  0  0  0  0  0
    3.7800    1.6700   -1.1200 H   0  0  0  0  0  0
    4.9400    0.7200   -0.1300 H   0  0  0  0  0  0
    4.7000    0.3200   -1.8700 H   0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  3  4  2  0
  4  5  1  0
  5  6  1  0
  5  7  1  0
  5  8  1  0
  8  9  2  0
  8 10  1  0
 10 11  1  0
 11 12  2  0
 11 13  1  0
  2 14  1  0
 15  1  1  0
 16  1  1  0
 17  1  1  0
 18  4  1  0
 19  6  1  0
 20  6  1  0
 21  6  1  0
 22  7  1  0
 23  7  1  0
 24  7  1  0
 25 10  1  0
 26 10  1  0
 27 12  1  0
 28 12  1  0
 29 13  1  0
 30 13  1  0
 31 13  1  0
 32 14  1  0
 33 14  1  0
 34 14  1  0
M  END

$$$$