TDT2MOL 
NCc1ccccc1N=N=N
 21 21  0  0  0  0              0      
    1.2200    2.6800   -0.6000 N   0  0  0  2  0  0
    0.5300    1.9400    0.4400 C   0  0  0  2  0  0
    0.6600    0.4700    0.1900 C   0  0  0  0  0  0
    1.9200   -0.1300    0.1700 C   0  0  0  1  0  0
    2.0400   -1.5100   -0.0600 C   0  0  0  1  0  0
    0.8900   -2.2800   -0.2700 C   0  0  0  1  0  0
   -0.3800   -1.6800   -0.2500 C   0  0  0  1  0  0
   -0.4900   -0.3000   -0.0200 C   0  0  0  0  0  0
   -1.7500    0.3100    0.0000 N   0  0  0  0  0  0
   -2.7600   -0.5500   -0.2200 N   0  0  0  1  0  0
   -3.5800   -0.9000    0.8000 N   0  0  0  1  0  0
    1.1200    3.6600   -0.4400 H   0  0  0  0  0  0
    0.8200    2.4400   -1.4900 H   0  0  0  0  0  0
    0.9700    2.1900    1.4200 H   0  0  0  0  0  0
   -0.5400    2.2200    0.4400 H   0  0  0  0  0  0
    2.8300    0.4700    0.3400 H   0  0  0  0  0  0
    3.0300   -1.9900   -0.0700 H   0  0  0  0  0  0
    0.9700   -3.3600   -0.4500 H   0  0  0  0  0  0
   -1.2800   -2.2800   -0.4100 H   0  0  0  0  0  0
   -2.9200   -0.9500   -1.1900 H   0  0  0  0  0  0
   -3.3000   -0.4700    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  2  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  2  0
 10 11  2  0
 12  1  1  0
 13  1  1  0
 14  2  1  0
 15  2  1  0
 16  4  1  0
 17  5  1  0
 18  6  1  0
 19  7  1  0
 20 10  1  0
 21 11  1  0
M  END

$$$$