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2 groups which cause the largest geometrical changes. The semiempirical PM3 frequency calculations indicate that the corrections to RE and TE are less than 0 2 kcal/mol.
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2Me are excluded.
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83
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85033855378
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6 positions. The same for S3/S5.
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87
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85033866567
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Manuscript in preparation
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Wu, Y.-D.; Wong, C.-L.; Li, B.-R.; Ji, G.-Z.; Jiang, X.-K. Manuscript in preparation.
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Wu, Y.-D.1
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Jiang, X.-K.5
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