TDT2MOL 
COc1cnccn1
 14 14  0  0  0  0              0      
   -2.3100   -0.7200   -0.1600 C   0  0  0  3  0  0
   -1.8000    0.5300   -0.1000 O   0  0  0  0  0  0
   -0.4000    0.4600   -0.0200 C   0  0  0  0  0  0
    0.3500    1.6300    0.0600 C   0  0  0  1  0  0
    1.7500    1.5700    0.1500 N   0  0  0  0  0  0
    2.3900    0.3200    0.1600 C   0  0  0  1  0  0
    1.6400   -0.8600    0.0800 C   0  0  0  1  0  0
    0.2400   -0.7900    0.0000 N   0  0  0  0  0  0
   -3.4000   -0.6700   -0.2400 H   0  0  0  0  0  0
   -1.9100   -1.2400   -1.0500 H   0  0  0  0  0  0
   -2.0300   -1.2800    0.7500 H   0  0  0  0  0  0
   -0.1500    2.6100    0.0500 H   0  0  0  0  0  0
    3.4900    0.2700    0.2300 H   0  0  0  0  0  0
    2.1400   -1.8300    0.0900 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
  9  1  1  0
 10  1  1  0
 11  1  1  0
 12  4  1  0
 13  6  1  0
 14  7  1  0
M  END

$$$$