
  TDT2MOL 
COCC1C2=C(c3ccccc13)P(=O)(c4ccccc4)c5ccccc5C2=O
 47 51  0  0  0  0              0      
    4.9700    1.1300   -0.8600 C   0  0  0  3  0  0
    3.8900    1.3100   -1.6300 O   0  0  0  0  0  0
    2.9000    0.4400   -1.3400 C   0  0  0  2  0  0
    2.4800    0.5800    0.0800 C   0  0  0  1  0  0
    1.3200   -0.3800    0.3700 C   0  0  0  0  0  0
    0.1800    0.3100    0.7400 C   0  0  0  0  0  0
    0.4900    1.7800    0.7300 C   0  0  0  0  0  0
   -0.2900    2.8700    1.0200 C   0  0  0  1  0  0
    0.2900    4.1400    0.9200 C   0  0  0  1  0  0
    1.6300    4.3000    0.5400 C   0  0  0  1  0  0
    2.4300    3.1900    0.2400 C   0  0  0  1  0  0
    1.8700    1.9300    0.3400 C   0  0  0  0  0  0
   -1.3200   -0.5300    1.1300 P   0  0  0  0  0  0
   -1.7600   -0.2600    2.5400 O   0  0  0  0  0  0
   -2.6400   -0.0500   -0.0100 C   0  0  0  0  0  0
   -2.6200   -0.5200   -1.3300 C   0  0  0  1  0  0
   -3.6400   -0.1500   -2.2100 C   0  0  0  1  0  0
   -4.6700    0.6800   -1.7800 C   0  0  0  1  0  0
   -4.6900    1.1500   -0.4600 C   0  0  0  1  0  0
   -3.6700    0.7800    0.4300 C   0  0  0  1  0  0
   -1.0100   -2.3100    0.9400 C   0  0  0  0  0  0
   -2.0400   -3.2100    1.2000 C   0  0  0  1  0  0
   -1.8200   -4.5900    1.0600 C   0  0  0  1  0  0
   -0.5600   -5.0500    0.6600 C   0  0  0  1  0  0
    0.4700   -4.1400    0.4100 C   0  0  0  1  0  0
    0.2500   -2.7600    0.5500 C   0  0  0  0  0  0
    1.4000   -1.8400    0.2600 C   0  0  0  0  0  0
    2.4900   -2.3800   -0.0900 O   0  0  0  0  0  0
    4.7900    1.5200    0.1500 H   0  0  0  0  0  0
    5.8200    1.7000   -1.3000 H   0  0  0  0  0  0
    5.2600    0.0700   -0.8000 H   0  0  0  0  0  0
    2.0500    0.6300   -2.0000 H   0  0  0  0  0  0
    3.2600   -0.5900   -1.5200 H   0  0  0  0  0  0
    3.2900    0.3700    0.7900 H   0  0  0  0  0  0
   -1.3400    2.7600    1.3200 H   0  0  0  0  0  0
   -0.3200    5.0300    1.1500 H   0  0  0  0  0  0
    2.0600    5.3100    0.4700 H   0  0  0  0  0  0
    3.4800    3.3300   -0.0500 H   0  0  0  0  0  0
   -1.8000   -1.1800   -1.6700 H   0  0  0  0  0  0
   -3.6300   -0.5200   -3.2500 H   0  0  0  0  0  0
   -5.4700    0.9700   -2.4800 H   0  0  0  0  0  0
   -5.5000    1.8100   -0.1200 H   0  0  0  0  0  0
   -3.6800    1.1500    1.4600 H   0  0  0  0  0  0
   -3.0300   -2.8400    1.5100 H   0  0  0  0  0  0
   -2.6300   -5.3000    1.2600 H   0  0  0  0  0  0
   -0.3800   -6.1300    0.5500 H   0  0  0  0  0  0
    1.4600   -4.5000    0.1000 H   0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4 12  1  0
  4  5  1  0
  5 27  1  0
  5  6  2  0
  6  7  1  0
  7 12  1  0
  7  8  2  0
  8  9  1  0
  9 10  2  0
 10 11  1  0
 11 12  2  0
  6 13  1  0
 13 14  2  0
 13 15  1  0
 15 20  1  0
 15 16  2  0
 16 17  1  0
 17 18  2  0
 18 19  1  0
 19 20  2  0
 13 21  1  0
 21 26  1  0
 21 22  2  0
 22 23  1  0
 23 24  2  0
 24 25  1  0
 25 26  2  0
 26 27  1  0
 27 28  2  0
 29  1  1  0
 30  1  1  0
 31  1  1  0
 32  3  1  0
 33  3  1  0
 34  4  1  0
 35  8  1  0
 36  9  1  0
 37 10  1  0
 38 11  1  0
 39 16  1  0
 40 17  1  0
 41 18  1  0
 42 19  1  0
 43 20  1  0
 44 22  1  0
 45 23  1  0
 46 24  1  0
 47 25  1  0
M  END

$$$$
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