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graphkit-learn/datasets/Alkane/molecule051.ct

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  1. molecule050.ct

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  7.    -1.5736   -1.3995    0.0000 C

  8.    -3.0736   -1.3995    0.0000 C

  9.    -2.1226    0.6495    0.0000 C

  10.    -0.0736    1.1986    0.0000 C

  11.     3.0736   -0.8505    0.0000 C

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