TDT2MOL 
CC1(CC(=C)C12)CC(=O)C2(C)C
 28 29  0  0  0  0              0      
   -1.7800    1.7000   -0.9700 C   0  0  0  3  0  0
   -1.0900    0.8500    0.0300 C   0  0  0  0  0  0
   -2.0000   -0.2700    0.5800 C   0  0  0  2  0  0
   -1.0100   -1.2800   -0.0800 C   0  0  0  0  0  0
   -0.9800   -2.5800   -0.1100 C   0  0  0  2  0  0
   -0.1000   -0.1800   -0.6700 C   0  0  0  1  0  0
   -0.3200    1.5600    1.0700 C   0  0  0  2  0  0
    1.0000    0.8200    1.1800 C   0  0  0  0  0  0
    1.8000    0.9400    2.1000 O   0  0  0  0  0  0
    1.2100   -0.1000   -0.0200 C   0  0  0  0  0  0
    1.7400   -1.4200    0.4700 C   0  0  0  3  0  0
    2.2400    0.5300   -0.9200 C   0  0  0  3  0  0
   -2.5400    2.3100   -0.4600 H   0  0  0  0  0  0
   -2.2600    1.0700   -1.7300 H   0  0  0  0  0  0
   -1.0500    2.3600   -1.4600 H   0  0  0  0  0  0
   -1.9700   -0.4000    1.6400 H   0  0  0  0  0  0
   -2.9600   -0.3700    0.1100 H   0  0  0  0  0  0
   -0.1800   -3.1300   -0.6400 H   0  0  0  0  0  0
   -1.7600   -3.1900    0.3900 H   0  0  0  0  0  0
   -0.1800   -0.2000   -1.7300 H   0  0  0  0  0  0
   -0.0800    2.6000    0.8100 H   0  0  0  0  0  0
   -0.7900    1.5500    2.0600 H   0  0  0  0  0  0
    1.9100   -2.0800   -0.3900 H   0  0  0  0  0  0
    1.0000   -1.8800    1.1400 H   0  0  0  0  0  0
    2.6800   -1.2700    1.0100 H   0  0  0  0  0  0
    2.4100   -0.1200   -1.7900 H   0  0  0  0  0  0
    1.8800    1.5100   -1.2600 H   0  0  0  0  0  0
    3.1800    0.6700   -0.3700 H   0  0  0  0  0  0
  1  2  1  0
  2  6  1  0
  2  3  1  0
  3  4  1  0
  4  5  2  0
  4  6  1  0
  6 10  1  0
  2  7  1  0
  7  8  1  0
  8  9  2  0
  8 10  1  0
 10 11  1  0
 10 12  1  0
 13  1  1  0
 14  1  1  0
 15  1  1  0
 16  3  1  0
 17  3  1  0
 18  5  1  0
 19  5  1  0
 20  6  1  0
 21  7  1  0
 22  7  1  0
 23 11  1  0
 24 11  1  0
 25 11  1  0
 26 12  1  0
 27 12  1  0
 28 12  1  0
M  END

$$$$