TDT2MOL 
CCSC1(OC2(C3C1C(=O)OC3=O)c4ccccc4)c5ccsc52
 38 42  0  0  0  0              0      
   -4.1100   -2.1400    0.2600 C   0  0  0  3  0  0
   -3.6400   -0.9400   -0.5300 C   0  0  0  2  0  0
   -2.9900    0.2900    0.5800 S   0  0  0  0  0  0
   -1.3200    0.7000    0.4300 C   0  0  0  0  0  0
   -0.4700   -0.4400    0.5200 O   0  0  0  0  0  0
    0.8000    0.1700    0.3300 C   0  0  0  0  0  0
    0.8100    1.1700    1.4100 C   0  0  0  1  0  0
   -0.7300    1.5700    1.4900 C   0  0  0  1  0  0
   -0.5200    3.0200    1.1600 C   0  0  0  0  0  0
   -0.8600    4.0200    1.6300 O   0  0  0  0  0  0
    0.4200    3.1000    0.1200 O   0  0  0  0  0  0
    1.3000    2.5500    1.0700 C   0  0  0  0  0  0
    2.1100    3.2500    1.5000 O   0  0  0  0  0  0
    1.8600   -0.8300    0.2600 C   0  0  0  0  0  0
    2.4100   -1.3700    1.4300 C   0  0  0  1  0  0
    3.4200   -2.3300    1.3600 C   0  0  0  1  0  0
    3.9100   -2.7600    0.1200 C   0  0  0  1  0  0
    3.3700   -2.2200   -1.0500 C   0  0  0  1  0  0
    2.3500   -1.2700   -0.9800 C   0  0  0  1  0  0
   -0.8800    1.2000   -0.9600 C   0  0  0  0  0  0
   -1.3900    1.8300   -2.0400 C   0  0  0  1  0  0
   -0.4800    2.0500   -3.0900 C   0  0  0  1  0  0
    1.0300    1.3800   -2.5300 S   0  0  0  0  0  0
    0.5400    0.8400   -1.0200 C   0  0  0  0  0  0
   -4.8800   -1.8200    0.9900 H   0  0  0  0  0  0
   -3.2600   -2.5700    0.7900 H   0  0  0  0  0  0
   -4.5500   -2.8900   -0.4100 H   0  0  0  0  0  0
   -4.5100   -0.5200   -1.0600 H   0  0  0  0  0  0
   -2.9200   -1.2800   -1.2800 H   0  0  0  0  0  0
    1.1900    0.8200    2.3500 H   0  0  0  0  0  0
   -1.1400    1.4200    2.4700 H   0  0  0  0  0  0
    2.0300   -1.0400    2.4100 H   0  0  0  0  0  0
    3.8400   -2.7400    2.2900 H   0  0  0  0  0  0
    4.7100   -3.5100    0.0700 H   0  0  0  0  0  0
    3.7400   -2.5500   -2.0300 H   0  0  0  0  0  0
    1.9200   -0.8500   -1.9100 H   0  0  0  0  0  0
   -2.4400    2.1500   -2.1200 H   0  0  0  0  0  0
   -0.6800    2.5300   -4.0500 H   0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  8  1  0
  4  5  1  0
  5  6  1  0
  6 24  1  0
  6  7  1  0
  7 12  1  0
  7  8  1  0
  8  9  1  0
  9 10  2  0
  9 11  1  0
 11 12  1  0
 12 13  2  0
  6 14  1  0
 14 19  1  0
 14 15  2  0
 15 16  1  0
 16 17  2  0
 17 18  1  0
 18 19  2  0
  4 20  1  0
 20 24  2  0
 20 21  1  0
 21 22  2  0
 22 23  1  0
 23 24  1  0
 25  1  1  0
 26  1  1  0
 27  1  1  0
 28  2  1  0
 29  2  1  0
 30  7  1  0
 31  8  1  0
 32 15  1  0
 33 16  1  0
 34 17  1  0
 35 18  1  0
 36 19  1  0
 37 21  1  0
 38 22  1  0
M  END

$$$$