C9H8O
  AspenMD 06302522202D 1   0.01000     0.00000

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   -0.5443   -0.7173    0.0000 C   0  0  0  0  0  0           0  0  0
    0.2387    0.2607    0.0000 C   0  0  0  0  0  0           0  0  0
    0.5347    0.0527    0.0000 C   0  0  0  0  0  0           0  0  0
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    0.7427    0.7007    0.0000 O   0  0  0  0  0  0           0  0  0
    0.9987    0.0687    0.0000 H   0  0  0  0  0  0           0  0  0
  1  2  2  0     0  0
  2  3  1  0     0  0
  3  4  2  0     0  0
  4  5  1  0     0  0
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  6  1  1  0     0  0
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  7  8  2  0     0  0
  8  9  1  0     0  0
  9 10  2  0     0  0
  9 11  1  0     0  0
M  END