TDT2MOL 
Nc1cnccn1
 12 12  0  0  0  0              0      
    2.1300    0.4500    0.4500 N   0  0  0  2  0  0
    0.7900    0.1700    0.1700 C   0  0  0  0  0  0
    0.4100   -1.1300   -0.1900 C   0  0  0  1  0  0
   -0.9300   -1.4100   -0.4700 N   0  0  0  0  0  0
   -1.8900   -0.4000   -0.4000 C   0  0  0  1  0  0
   -1.5100    0.9000   -0.0400 C   0  0  0  1  0  0
   -0.1700    1.1800    0.2400 N   0  0  0  0  0  0
    2.4100    1.3800    0.7000 H   0  0  0  0  0  0
    2.8200   -0.2700    0.3900 H   0  0  0  0  0  0
    1.1700   -1.9300   -0.2600 H   0  0  0  0  0  0
   -2.9500   -0.6200   -0.6200 H   0  0  0  0  0  0
   -2.2700    1.7000    0.0300 H   0  0  0  0  0  0
  1  2  1  0
  2  7  1  0
  2  3  2  0
  3  4  1  0
  4  5  2  0
  5  6  1  0
  6  7  2  0
  8  1  1  0
  9  1  1  0
 10  3  1  0
 11  5  1  0
 12  6  1  0
M  END

$$$$