TDT2MOL 
CC(C)Cc1cc(CO)co1
 25 25  0  0  0  0              0      
   -3.5500    0.0400    0.3400 C   0  0  0  3  0  0
   -2.1300    0.0600   -0.1400 C   0  0  0  1  0  0
   -1.6600   -1.3400   -0.3900 C   0  0  0  3  0  0
   -1.2600    0.7100    0.8900 C   0  0  0  2  0  0
    0.1600    0.7700    0.4000 C   0  0  0  0  0  0
    1.1200   -0.2400    0.5100 C   0  0  0  1  0  0
    2.3000    0.2200   -0.0700 C   0  0  0  0  0  0
    3.5900   -0.5400   -0.1700 C   0  0  0  2  0  0
    4.5200    0.2400   -0.7700 O   0  0  0  1  0  0
    2.0800    1.5200   -0.5400 C   0  0  0  1  0  0
    0.7500    1.8600   -0.2500 O   0  0  0  0  0  0
   -4.1900   -0.4400   -0.4200 H   0  0  0  0  0  0
   -3.6100   -0.5300    1.2800 H   0  0  0  0  0  0
   -3.9000    1.0700    0.5100 H   0  0  0  0  0  0
   -2.0700    0.6400   -1.0800 H   0  0  0  0  0  0
   -1.7100   -1.9100    0.5500 H   0  0  0  0  0  0
   -2.3000   -1.8100   -1.1500 H   0  0  0  0  0  0
   -0.6200   -1.3200   -0.7500 H   0  0  0  0  0  0
   -1.6100    1.7300    1.0900 H   0  0  0  0  0  0
   -1.3000    0.1300    1.8300 H   0  0  0  0  0  0
    0.9700   -1.2300    0.9800 H   0  0  0  0  0  0
    3.9400   -0.8100    0.8300 H   0  0  0  0  0  0
    3.4400   -1.4500   -0.7700 H   0  0  0  0  0  0
    4.2300    0.4800   -1.6400 H   0  0  0  0  0  0
    2.8100    2.1600   -1.0500 H   0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  2  4  1  0
  4  5  1  0
  5 11  1  0
  5  6  2  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  7 10  2  0
 10 11  1  0
 12  1  1  0
 13  1  1  0
 14  1  1  0
 15  2  1  0
 16  3  1  0
 17  3  1  0
 18  3  1  0
 19  4  1  0
 20  4  1  0
 21  6  1  0
 22  8  1  0
 23  8  1  0
 24  9  1  0
 25 10  1  0
M  END

$$$$