TDT2MOL 
O=c1c2cccnc2c(C#N)c3ccccn13
 24 26  0  0  0  0              0      
    0.5700    2.4200   -1.1300 O   0  0  0  0  0  0
    0.3500    1.3000   -0.6100 C   0  0  0  0  0  0
    1.4200    0.4700   -0.2500 C   0  0  0  0  0  0
    2.7400    0.9000   -0.4800 C   0  0  0  1  0  0
    3.8100    0.0700   -0.1200 C   0  0  0  1  0  0
    3.5700   -1.1800    0.4600 C   0  0  0  1  0  0
    2.2500   -1.6000    0.6900 N   0  0  0  0  0  0
    1.1800   -0.7700    0.3300 C   0  0  0  0  0  0
   -0.1400   -1.2000    0.5600 C   0  0  0  0  0  0
   -0.4000   -2.5400    1.1800 C   0  0  0  0  0  0
   -0.4700   -3.5900    1.6400 N   0  0  0  0  0  0
   -1.2100   -0.3700    0.2000 C   0  0  0  0  0  0
   -2.5200   -0.7900    0.4300 C   0  0  0  1  0  0
   -3.6000    0.0300    0.0700 C   0  0  0  1  0  0
   -3.3500    1.2800   -0.5100 C   0  0  0  1  0  0
   -2.0400    1.7000   -0.7400 C   0  0  0  1  0  0
   -0.9700    0.8800   -0.3800 N   0  0  0  0  0  0
    2.9300    1.8800   -0.9400 H   0  0  0  0  0  0
    4.8400    0.4000   -0.3000 H   0  0  0  0  0  0
    4.4100   -1.8300    0.7400 H   0  0  0  0  0  0
   -2.7100   -1.7800    0.8900 H   0  0  0  0  0  0
   -4.6300   -0.3000    0.2500 H   0  0  0  0  0  0
   -4.2000    1.9300   -0.7900 H   0  0  0  0  0  0
   -1.8500    2.6900   -1.2000 H   0  0  0  0  0  0
  1  2  2  0
  2 17  1  0
  2  3  1  0
  3  8  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  1  0
 10 11  3  0
  9 12  2  0
 12 17  1  0
 12 13  1  0
 13 14  2  0
 14 15  1  0
 15 16  2  0
 16 17  1  0
 18  4  1  0
 19  5  1  0
 20  6  1  0
 21 13  1  0
 22 14  1  0
 23 15  1  0
 24 16  1  0
M  END

$$$$