MB6
  CCTOOLS-0919241034

 35 36  0  0  0  0  0  0  0  0999 V2000
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    4.0950    2.3100    0.0790 C   0  0  0  0  0
    3.2740    1.8780   -0.9470 C   0  0  0  0  0
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    4.6070    1.3990    0.9860 C   0  0  0  0  0
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    3.4670   -0.3730   -0.1520 C   0  0  0  0  0
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    4.1200   -2.7950    0.3400 O   0  0  0  0  0
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M  END
$$$$
