TDT2MOL 
COc1nccc2c3ccccc3nc(*)c12)c12
 26 28  0  0  0  0              0      
    4.3900   -0.0700   -0.8800 C   0  0  0  3  0  0
    3.1200   -0.0800   -1.3500 O   0  0  0  0  0  0
    2.2300   -0.0300   -0.2700 C   0  0  0  0  0  0
    2.7200    0.0300    1.0400 N   0  0  0  0  0  0
    1.8100    0.0800    2.1000 C   0  0  0  1  0  0
    0.4200    0.0800    1.8500 C   0  0  0  1  0  0
   -0.0700    0.0200    0.5500 C   0  0  0  0  0  0
   -1.4400    0.0200    0.2600 C   0  0  0  0  0  0
   -2.4100    0.0700    1.2700 C   0  0  0  1  0  0
   -3.7800    0.0700    0.9500 C   0  0  0  1  0  0
   -4.2000    0.0100   -0.3800 C   0  0  0  1  0  0
   -3.2300   -0.0400   -1.3900 C   0  0  0  1  0  0
   -1.8700   -0.0300   -1.0700 C   0  0  0  0  0  0
   -0.9500   -0.0800   -2.1200 N   0  0  0  0  0  0
    0.4200   -0.0800   -1.8400 C   0  0  0  0  0  0
    1.3200   -0.1300   -2.8400 R   0  0  0  0  0  0
    0.8500   -0.0300   -0.5100 C   0  0  0  0  0  0
    5.0900   -0.1100   -1.7300 H   0  0  0  0  0  0
    4.5600    0.8500   -0.3100 H   0  0  0  0  0  0
    4.5500   -0.9400   -0.2300 H   0  0  0  0  0  0
    2.1600    0.1200    3.1400 H   0  0  0  0  0  0
   -0.2300    0.1200    2.7300 H   0  0  0  0  0  0
   -2.1500    0.1200    2.3400 H   0  0  0  0  0  0
   -4.5100    0.1100    1.7700 H   0  0  0  0  0  0
   -5.2700    0.0100   -0.6200 H   0  0  0  0  0  0
   -3.5400   -0.0800   -2.4500 H   0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3 17  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7 17  1  0
  7  8  2  0
  8 13  1  0
  8  9  1  0
  9 10  2  0
 10 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  2  0
 14 15  1  0
 15 16  1  0
 15 17  2  0
 18  1  1  0
 19  1  1  0
 20  1  1  0
 21  5  1  0
 22  6  1  0
 23  9  1  0
 24 10  1  0
 25 11  1  0
 26 12  1  0
M  END

$$$$