C8O2
ww   csweb06050913132D 0   0.00000     0.00000
 
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  288.8576  262.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  261.1424  118.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  288.8576  134.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  233.4304  134.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  288.8576  166.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  233.4304  166.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  288.8576  230.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  261.1424  182.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  316.5696  214.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  261.1424  214.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  308.6976  262.0000    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  288.8576  281.8400    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  269.0176  262.0000    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  261.1419   98.1600    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  306.0394  124.0797    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  216.2484  124.0801    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  306.0394  175.9203    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  216.2484  175.9199    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  7  1  0  0  0  0
  2  3  2  0  0  0  0
  2  4  1  0  0  0  0
  3  5  1  0  0  0  0
  4  6  2  0  0  0  0
  5  8  2  0  0  0  0
  6  8  1  0  0  0  0
  7  9  2  0  0  0  0
  7 10  1  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
  6 18  1  0  0  0  0
M  END
$$$$