TDT2MOL 
*c1ccc2noc3C4=C(CCC=C4)C(=O)c1c321c32
 26 29  0  0  0  0              0      
    3.1300    2.2800    1.0100 R   0  0  0  0  0  0
    2.9000    1.0300    0.5700 C   0  0  0  0  0  0
    3.9800    0.1400    0.3900 C   0  0  0  1  0  0
    3.8000   -1.1700   -0.0700 C   0  0  0  1  0  0
    2.5100   -1.6200   -0.3500 C   0  0  0  0  0  0
    1.9600   -2.8100   -0.8000 N   0  0  0  0  0  0
    0.5600   -2.6500   -0.8900 O   0  0  0  0  0  0
    0.2500   -1.3600   -0.5000 C   0  0  0  0  0  0
   -1.0300   -0.5800   -0.3700 C   0  0  0  0  0  0
   -0.9600    0.7000    0.0600 C   0  0  0  0  0  0
   -2.2100    1.5300    0.1800 C   0  0  0  2  0  0
   -3.4600    0.7700    0.3100 C   0  0  0  2  0  0
   -3.4700   -0.5600   -0.3900 C   0  0  0  1  0  0
   -2.3300   -1.2000   -0.6900 C   0  0  0  1  0  0
    0.3500    1.3700    0.4200 C   0  0  0  0  0  0
    0.3600    2.5500    0.8100 O   0  0  0  0  0  0
    1.6100    0.5800    0.2900 C   0  0  0  0  0  0
    1.4600   -0.7300   -0.1600 C   0  0  0  0  0  0
    5.0000    0.5000    0.6100 H   0  0  0  0  0  0
    4.6700   -1.8300   -0.2000 H   0  0  0  0  0  0
   -2.2100    2.1600   -0.7500 H   0  0  0  0  0  0
   -2.0400    2.2500    1.0100 H   0  0  0  0  0  0
   -4.3500    1.3400   -0.0300 H   0  0  0  0  0  0
   -3.6600    0.5200    1.3900 H   0  0  0  0  0  0
   -4.4500   -1.0100   -0.6500 H   0  0  0  0  0  0
   -2.3700   -2.1900   -1.1800 H   0  0  0  0  0  0
  1  2  1  0
  2 17  2  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5 18  1  0
  5  6  2  0
  6  7  1  0
  7  8  1  0
  8 18  2  0
  8  9  1  0
  9 14  1  0
  9 10  2  0
 10 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  2  0
 10 15  1  0
 15 16  2  0
 15 17  1  0
 17 18  1  0
 19  3  1  0
 20  4  1  0
 21 11  1  0
 22 11  1  0
 23 12  1  0
 24 12  1  0
 25 13  1  0
 26 14  1  0
M  END

$$$$