C8O2
ww   csweb06040913322D 0   0.00000     0.00000
 
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  247.2864  198.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  302.7136  198.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  247.2864  166.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  302.7136  166.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  274.9984  246.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  274.9984  214.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  274.9984  150.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  247.2864  262.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  274.9984  118.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  312.6330  244.8177    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  319.8959  271.9194    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  292.7942  279.1823    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  230.1044  207.9199    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  319.8954  207.9203    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  230.1044  156.0801    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  319.8954  156.0797    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  257.8165  108.0800    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  6  1  0  0  0  0
  2  4  1  0  0  0  0
  2  7  2  0  0  0  0
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  4  8  2  0  0  0  0
  5  8  1  0  0  0  0
  6  7  1  0  0  0  0
  6  9  2  0  0  0  0
  8 10  1  0  0  0  0
  1 11  1  0  0  0  0
  1 12  1  0  0  0  0
  1 13  1  0  0  0  0
  2 14  1  0  0  0  0
  3 15  1  0  0  0  0
  4 16  1  0  0  0  0
  5 17  1  0  0  0  0
 10 18  1  0  0  0  0
M  END
$$$$