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graphkit-learn/datasets/Alkane/molecule004.ct

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  1. molecule3.ct

  2. 4 3

  3.     1.1250    1.2990    0.0000 C

  4.     0.3750   -0.0000    0.0000 C

  5.     1.1250   -1.2990    0.0000 C

  6.    -1.1250   -0.0000    0.0000 C

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