TDT2MOL 
CC12CC(=O)NC2NC(=C1)c3ccccc3OC(=O)O
 34 36  0  0  0  0              0      
    3.0000   -1.1300   -0.4800 C   0  0  0  3  0  0
    2.2500    0.1600   -0.2900 C   0  0  0  0  0  0
    2.7600    1.2700   -1.1400 C   0  0  0  2  0  0
    2.9500    2.3900   -0.1500 C   0  0  0  0  0  0
    3.2700    3.4800   -0.2100 O   0  0  0  0  0  0
    2.6600    2.0000    1.2500 N   0  0  0  1  0  0
    2.3000    0.6500    1.1600 C   0  0  0  1  0  0
    0.9100    0.5200    1.6500 N   0  0  0  1  0  0
    0.0300    0.0400    0.5800 C   0  0  0  0  0  0
    0.7700   -0.1600   -0.5400 C   0  0  0  1  0  0
   -1.4300   -0.1600    0.7400 C   0  0  0  0  0  0
   -2.0200    0.1100    1.9800 C   0  0  0  1  0  0
   -3.3900   -0.0700    2.1600 C   0  0  0  1  0  0
   -4.1700   -0.5200    1.0900 C   0  0  0  1  0  0
   -3.5800   -0.7900   -0.1600 C   0  0  0  1  0  0
   -2.2200   -0.6000   -0.3400 C   0  0  0  0  0  0
   -1.5500   -0.8600   -1.5400 O   0  0  0  0  0  0
   -2.4900   -1.2300   -2.4400 C   0  0  0  0  0  0
   -3.4100   -0.3900   -2.5800 O   0  0  0  0  0  0
   -2.4300   -2.3800   -3.1300 O   0  0  0  1  0  0
    2.8500   -1.5100   -1.5000 H   0  0  0  0  0  0
    2.6600   -1.8700    0.2500 H   0  0  0  0  0  0
    4.0800   -0.9400   -0.3300 H   0  0  0  0  0  0
    2.0800    1.6200   -1.9200 H   0  0  0  0  0  0
    3.7500    1.1000   -1.6000 H   0  0  0  0  0  0
    2.7400    2.6200    2.0000 H   0  0  0  0  0  0
    2.9300    0.0600    1.8100 H   0  0  0  0  0  0
    0.6300    0.7500    2.5600 H   0  0  0  0  0  0
    0.4100   -0.5100   -1.4900 H   0  0  0  0  0  0
   -1.3900    0.4700    2.8100 H   0  0  0  0  0  0
   -3.8500    0.1400    3.1300 H   0  0  0  0  0  0
   -5.2600   -0.6600    1.2200 H   0  0  0  0  0  0
   -4.2400   -1.1500   -0.9600 H   0  0  0  0  0  0
   -1.5900   -2.4600   -3.5700 H   0  0  0  0  0  0
  1  2  1  0
  2 10  1  0
  2  7  1  0
  2  3  1  0
  3  4  1  0
  4  5  2  0
  4  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  2  0
  9 11  1  0
 11 16  1  0
 11 12  2  0
 12 13  1  0
 13 14  2  0
 14 15  1  0
 15 16  2  0
 16 17  1  0
 17 18  1  0
 18 19  2  0
 18 20  1  0
 21  1  1  0
 22  1  1  0
 23  1  1  0
 24  3  1  0
 25  3  1  0
 26  6  1  0
 27  7  1  0
 28  8  1  0
 29 10  1  0
 30 12  1  0
 31 13  1  0
 32 14  1  0
 33 15  1  0
 34 20  1  0
M  END

$$$$