TDT2MOL 
CN1NC2OC3=C(C(=O)CC(*)(*)C3)C2(C)CC1=OC1=OC1=O
 33 35  0  0  0  0              0      
    4.3800    0.6500   -0.0500 C   0  0  0  3  0  0
    2.9700    0.4600    0.1900 N   0  0  0  0  0  0
    1.9900    1.4500   -0.1900 N   0  0  0  1  0  0
    0.7700    0.9500   -0.7000 C   0  0  0  1  0  0
   -0.2500    1.7900   -0.2500 O   0  0  0  0  0  0
   -1.3800    1.0600   -0.1000 C   0  0  0  0  0  0
   -1.1100   -0.2900   -0.1000 C   0  0  0  0  0  0
   -2.1800   -1.2900    0.0500 C   0  0  0  0  0  0
   -1.9700   -2.5200    0.0500 O   0  0  0  0  0  0
   -3.5900   -0.7700    0.2200 C   0  0  0  2  0  0
   -3.5500    0.5700    0.8900 C   0  0  0  0  0  0
   -4.8600    1.0400    1.0400 R   0  0  0  0  0  0
   -2.9600    0.4500    2.1500 R   0  0  0  0  0  0
   -2.7600    1.5500    0.0600 C   0  0  0  2  0  0
    0.3800   -0.4500   -0.2800 C   0  0  0  0  0  0
    0.6600   -1.5000   -1.3100 C   0  0  0  3  0  0
    1.0000   -0.8400    1.0300 C   0  0  0  2  0  0
    2.4900   -0.7600    0.8400 C   0  0  0  0  0  0
    3.2600   -1.6600    1.2000 O   0  0  0  0  0  0
    4.5500    1.6700   -0.4300 H   0  0  0  0  0  0
    4.7300   -0.0700   -0.8000 H   0  0  0  0  0  0
    4.9300    0.5100    0.8900 H   0  0  0  0  0  0
    2.4100    2.1900   -0.7000 H   0  0  0  0  0  0
    0.7100    1.0600   -1.8000 H   0  0  0  0  0  0
   -4.1500   -1.4900    0.8400 H   0  0  0  0  0  0
   -4.0600   -0.6900   -0.7700 H   0  0  0  0  0  0
   -2.7700    2.5300    0.5600 H   0  0  0  0  0  0
   -3.2500    1.6500   -0.9300 H   0  0  0  0  0  0
    1.7500   -1.6200   -1.4300 H   0  0  0  0  0  0
    0.2200   -2.4500   -0.9800 H   0  0  0  0  0  0
    0.2100   -1.2000   -2.2700 H   0  0  0  0  0  0
    0.7200   -0.1200    1.8200 H   0  0  0  0  0  0
    0.7100   -1.8500    1.3200 H   0  0  0  0  0  0
  1  2  1  0
  2 18  1  0
  2  3  1  0
  3  4  1  0
  4 15  1  0
  4  5  1  0
  5  6  1  0
  6 14  1  0
  6  7  2  0
  7  8  1  0
  8  9  2  0
  8 10  1  0
 10 11  1  0
 11 12  1  0
 11 13  1  0
 11 14  1  0
  7 15  1  0
 15 16  1  0
 15 17  1  0
 17 18  1  0
 18 19  2  0
 20  1  1  0
 21  1  1  0
 22  1  1  0
 23  3  1  0
 24  4  1  0
 25 10  1  0
 26 10  1  0
 27 14  1  0
 28 14  1  0
 29 16  1  0
 30 16  1  0
 31 16  1  0
 32 17  1  0
 33 17  1  0
M  END

$$$$