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graphkit-learn/datasets/Alkane/molecule037.ct

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  1. molecule036.ct

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  4.    -2.6250   -0.0000    0.0000 C

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  6.    -0.3750   -1.2990    0.0000 C

  7.     1.1250   -1.2990    0.0000 C

  8.     1.8750    0.0000    0.0000 C

  9.     3.3750    0.0000    0.0000 C

  10.    -0.3750    1.2990    0.0000 C

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