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Data underlying the publication: C. L. Hobday, R. J. Marshall, C. F. Murphie, J. Sotelo, T. Richards, D. R. Allan, T. Düren, F.-X. Coudert, R. S. Forgan, C. A. Morrison, S. A. Moggach, T. D. Bennett, Angew. Chem. Int. Ed. 2016, 55, 2401.
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