TDT2MOL 
COC(=O)C1=C(C)CN(C1)Sc2ccccc2
 32 33  0  0  0  0              0      
   -5.0100    1.5500   -0.3800 C   0  0  0  3  0  0
   -3.8800    1.2300    0.3000 O   0  0  0  0  0  0
   -3.4900   -0.0200   -0.0400 C   0  0  0  0  0  0
   -4.3600   -0.8000   -0.5100 O   0  0  0  0  0  0
   -2.1000   -0.4500    0.1200 C   0  0  0  0  0  0
   -1.6000   -1.6800   -0.1900 C   0  0  0  0  0  0
   -2.3600   -2.8100   -0.7500 C   0  0  0  3  0  0
   -0.1100   -1.7200    0.1300 C   0  0  0  2  0  0
    0.2300   -0.3500    0.4600 N   0  0  0  0  0  0
   -0.9800    0.4200    0.6800 C   0  0  0  2  0  0
    1.4800   -0.1300    1.6000 S   0  0  0  0  0  0
    2.9700    0.5000    0.8000 C   0  0  0  0  0  0
    4.1900    0.4800    1.4900 C   0  0  0  1  0  0
    5.3500    0.9700    0.8700 C   0  0  0  1  0  0
    5.2800    1.4800   -0.4400 C   0  0  0  1  0  0
    4.0600    1.4900   -1.1200 C   0  0  0  1  0  0
    2.9100    1.0000   -0.5000 C   0  0  0  1  0  0
   -5.8000    0.8300   -0.1300 H   0  0  0  0  0  0
   -5.3300    2.5600   -0.1000 H   0  0  0  0  0  0
   -4.8100    1.5100   -1.4600 H   0  0  0  0  0  0
   -2.4600   -3.6200   -0.0100 H   0  0  0  0  0  0
   -3.3700   -2.5000   -1.0500 H   0  0  0  0  0  0
   -1.8400   -3.2200   -1.6400 H   0  0  0  0  0  0
    0.0400   -2.4100    0.9700 H   0  0  0  0  0  0
    0.4300   -2.0600   -0.7600 H   0  0  0  0  0  0
   -1.1800    0.6100    1.7300 H   0  0  0  0  0  0
   -0.9500    1.3600    0.1100 H   0  0  0  0  0  0
    4.2500    0.0900    2.5100 H   0  0  0  0  0  0
    6.3100    0.9700    1.4000 H   0  0  0  0  0  0
    6.1900    1.8600   -0.9300 H   0  0  0  0  0  0
    4.0100    1.8800   -2.1500 H   0  0  0  0  0  0
    1.9500    1.0100   -1.0400 H   0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  3  5  1  0
  5 10  1  0
  5  6  2  0
  6  7  1  0
  6  8  1  0
  8  9  1  0
  9 10  1  0
  9 11  1  0
 11 12  1  0
 12 17  1  0
 12 13  2  0
 13 14  1  0
 14 15  2  0
 15 16  1  0
 16 17  2  0
 18  1  1  0
 19  1  1  0
 20  1  1  0
 21  7  1  0
 22  7  1  0
 23  7  1  0
 24  8  1  0
 25  8  1  0
 26 10  1  0
 27 10  1  0
 28 13  1  0
 29 14  1  0
 30 15  1  0
 31 16  1  0
 32 17  1  0
M  END

$$$$