TDT2MOL 
COc1cc(C)nn1c2ccccc2
 26 27  0  0  0  0              0      
   -2.5000   -2.0900    0.3700 C   0  0  0  3  0  0
   -1.2100   -1.7200    0.2400 O   0  0  0  0  0  0
   -1.1400   -0.3300    0.1000 C   0  0  0  0  0  0
   -2.2200    0.5600    0.0900 C   0  0  0  1  0  0
   -1.6900    1.8400   -0.0700 C   0  0  0  0  0  0
   -2.4800    3.1200   -0.1400 C   0  0  0  3  0  0
   -0.3000    1.7200   -0.1500 N   0  0  0  0  0  0
    0.0300    0.4200   -0.0500 N   0  0  0  0  0  0
    1.3400   -0.0900   -0.0800 C   0  0  0  0  0  0
    1.7100   -1.0000   -1.0800 C   0  0  0  1  0  0
    3.0100   -1.5100   -1.1100 C   0  0  0  1  0  0
    3.9400   -1.1100   -0.1400 C   0  0  0  1  0  0
    3.5700   -0.2000    0.8500 C   0  0  0  1  0  0
    2.2700    0.3100    0.8800 C   0  0  0  1  0  0
   -2.9300   -1.6200    1.2600 H   0  0  0  0  0  0
   -2.5600   -3.1900    0.4700 H   0  0  0  0  0  0
   -3.0700   -1.7800   -0.5200 H   0  0  0  0  0  0
   -3.2800    0.2900    0.1900 H   0  0  0  0  0  0
   -2.9000    3.3400    0.8400 H   0  0  0  0  0  0
   -3.2900    3.0100   -0.8800 H   0  0  0  0  0  0
   -1.8100    3.9400   -0.4500 H   0  0  0  0  0  0
    0.9700   -1.3200   -1.8400 H   0  0  0  0  0  0
    3.3000   -2.2300   -1.8900 H   0  0  0  0  0  0
    4.9700   -1.5100   -0.1700 H   0  0  0  0  0  0
    4.3000    0.1200    1.6100 H   0  0  0  0  0  0
    1.9800    1.0300    1.6600 H   0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  8  1  0
  3  4  2  0
  4  5  1  0
  5  6  1  0
  5  7  2  0
  7  8  1  0
  8  9  1  0
  9 14  1  0
  9 10  2  0
 10 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  2  0
 15  1  1  0
 16  1  1  0
 17  1  1  0
 18  4  1  0
 19  6  1  0
 20  6  1  0
 21  6  1  0
 22 10  1  0
 23 11  1  0
 24 12  1  0
 25 13  1  0
 26 14  1  0
M  END

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