TDT2MOL 
CC=CC=O
 11 10  0  0  0  0              0      
   -1.7400    0.1100    0.2300 C   0  0  0  3  0  0
   -0.3200    0.4700   -0.0700 C   0  0  0  1  0  0
    0.6500   -0.4700    0.0200 C   0  0  0  1  0  0
    2.0700   -0.1100   -0.2800 C   0  0  0  1  0  0
    2.9700   -0.9800   -0.1900 O   0  0  0  0  0  0
   -1.9000   -0.9700    0.0400 H   0  0  0  0  0  0
   -2.4200    0.6900   -0.4100 H   0  0  0  0  0  0
   -1.9600    0.3300    1.2900 H   0  0  0  0  0  0
   -0.0600    1.5000   -0.3700 H   0  0  0  0  0  0
    0.3900   -1.4900    0.3200 H   0  0  0  0  0  0
    2.3300    0.9200   -0.5800 H   0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  3  4  1  0
  4  5  2  0
  6  1  1  0
  7  1  1  0
  8  1  1  0
  9  2  1  0
 10  3  1  0
 11  4  1  0
M  END

$$$$