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CH = 1.92 it is 92.7 kcal/mol
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e is 92.7, 104.9, and 109.5 kcal/ mol for the Brenner, MAPS/HDIAM, and MAPS/CH4 potentials, respectively
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e is 92.7, 104.9, and 109.5 kcal/ mol for the Brenner, MAPS/HDIAM, and MAPS/CH4 potentials, respectively.
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