TDT2MOL 
c1ccc2c(c1)oc3ccccc32
 21 23  0  0  0  0              0      
   -3.3800   -0.3500   -0.5300 C   0  0  0  1  0  0
   -3.0000   -0.5100    0.8100 C   0  0  0  1  0  0
   -1.6600   -0.4000    1.1900 C   0  0  0  1  0  0
   -0.7000   -0.1200    0.2200 C   0  0  0  0  0  0
   -1.0700    0.0400   -1.1200 C   0  0  0  0  0  0
   -2.4000   -0.0800   -1.5100 C   0  0  0  1  0  0
    0.0800    0.3000   -1.8700 O   0  0  0  0  0  0
    1.1600    0.3000   -0.9900 C   0  0  0  0  0  0
    2.5100    0.5100   -1.2100 C   0  0  0  1  0  0
    3.4000    0.4600   -0.1300 C   0  0  0  1  0  0
    2.9200    0.2000    1.1600 C   0  0  0  1  0  0
    1.5500   -0.0100    1.3800 C   0  0  0  1  0  0
    0.6800    0.0400    0.3000 C   0  0  0  0  0  0
   -4.4300   -0.4400   -0.8200 H   0  0  0  0  0  0
   -3.7700   -0.7300    1.5700 H   0  0  0  0  0  0
   -1.3700   -0.5200    2.2400 H   0  0  0  0  0  0
   -2.7000    0.0500   -2.5600 H   0  0  0  0  0  0
    2.8900    0.7200   -2.2200 H   0  0  0  0  0  0
    4.4800    0.6200   -0.2900 H   0  0  0  0  0  0
    3.6200    0.1600    2.0100 H   0  0  0  0  0  0
    1.1900   -0.2200    2.3900 H   0  0  0  0  0  0
  1  6  1  0
  1  2  2  0
  2  3  1  0
  3  4  2  0
  4 13  1  0
  4  5  1  0
  5  6  2  0
  5  7  1  0
  7  8  1  0
  8 13  1  0
  8  9  2  0
  9 10  1  0
 10 11  2  0
 11 12  1  0
 12 13  2  0
 14  1  1  0
 15  2  1  0
 16  3  1  0
 17  6  1  0
 18  9  1  0
 19 10  1  0
 20 11  1  0
 21 12  1  0
M  END

$$$$