TDT2MOL 
CC(C)Cc1cc(co1)C2CC=C(C)C(=O)C2
 37 38  0  0  0  0              0      
    5.5500   -0.8000   -0.0500 C   0  0  0  3  0  0
    4.2500   -0.3300   -0.6100 C   0  0  0  1  0  0
    4.2000    1.1700   -0.5700 C   0  0  0  3  0  0
    3.1200   -0.8900    0.2000 C   0  0  0  2  0  0
    1.8100   -0.4300   -0.3700 C   0  0  0  0  0  0
    0.6000   -0.3300    0.3200 C   0  0  0  1  0  0
   -0.3800    0.1400   -0.5600 C   0  0  0  0  0  0
    0.2300    0.3300   -1.8100 C   0  0  0  1  0  0
    1.5800   -0.0200   -1.6900 O   0  0  0  0  0  0
   -1.8200    0.3800   -0.2300 C   0  0  0  1  0  0
   -2.6500   -0.7400   -0.7600 C   0  0  0  2  0  0
   -4.1000   -0.5100   -0.4400 C   0  0  0  1  0  0
   -4.4700    0.1800    0.6600 C   0  0  0  0  0  0
   -5.9200    0.4000    0.9600 C   0  0  0  3  0  0
   -3.4200    0.7200    1.5900 C   0  0  0  0  0  0
   -3.7400    1.3600    2.6100 O   0  0  0  0  0  0
   -1.9700    0.4800    1.2600 C   0  0  0  2  0  0
    6.3800   -0.3900   -0.6400 H   0  0  0  0  0  0
    5.5900   -1.9000   -0.0800 H   0  0  0  0  0  0
    5.6500   -0.4600    0.9900 H   0  0  0  0  0  0
    4.1500   -0.6700   -1.6500 H   0  0  0  0  0  0
    5.0200    1.5800   -1.1700 H   0  0  0  0  0  0
    4.2900    1.5100    0.4700 H   0  0  0  0  0  0
    3.2400    1.5200   -0.9900 H   0  0  0  0  0  0
    3.1600   -1.9900    0.1700 H   0  0  0  0  0  0
    3.2100   -0.5500    1.2400 H   0  0  0  0  0  0
    0.4400   -0.5800    1.3800 H   0  0  0  0  0  0
   -0.2600    0.7000   -2.7200 H   0  0  0  0  0  0
   -2.1400    1.3300   -0.7000 H   0  0  0  0  0  0
   -2.5300   -0.8200   -1.8500 H   0  0  0  0  0  0
   -2.3300   -1.6900   -0.2900 H   0  0  0  0  0  0
   -4.8800   -0.9000   -1.1200 H   0  0  0  0  0  0
   -6.0500    0.5500    2.0400 H   0  0  0  0  0  0
   -6.2700    1.2900    0.4200 H   0  0  0  0  0  0
   -6.5000   -0.4700    0.6400 H   0  0  0  0  0  0
   -1.6400   -0.4600    1.7200 H   0  0  0  0  0  0
   -1.3700    1.3100    1.6400 H   0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  2  4  1  0
  4  5  1  0
  5  9  1  0
  5  6  2  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  7 10  1  0
 10 17  1  0
 10 11  1  0
 11 12  1  0
 12 13  2  0
 13 14  1  0
 13 15  1  0
 15 16  2  0
 15 17  1  0
 18  1  1  0
 19  1  1  0
 20  1  1  0
 21  2  1  0
 22  3  1  0
 23  3  1  0
 24  3  1  0
 25  4  1  0
 26  4  1  0
 27  6  1  0
 28  8  1  0
 29 10  1  0
 30 11  1  0
 31 11  1  0
 32 12  1  0
 33 14  1  0
 34 14  1  0
 35 14  1  0
 36 17  1  0
 37 17  1  0
M  END

$$$$