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6
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33645806352
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Cummins, P.L.1
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7
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85033044958
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unpublished data
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A. J. Blake (unpublished data). Spherical atom refinement (i.e., the standard model applied in x-ray structure determination) in I 4mm gives an R-factor of 0.03, with a C-N bond length of 1.132 (2) Å.
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Blake, A.J.1
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9
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0001295981
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18
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0001638907
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(c) S. T. Howard, M. B. Hursthouse, C. W. Lehmann, P. R. Mallinson, and C. S. Frampton, J. Chem. Phys. 97, 5616 (1992).
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23
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84893169025
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Generalized Atomic and Molecular Electronic Structure System
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November 1995 version
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Generalized Atomic and Molecular Electronic Structure System, November 1995 version, M. W. Schmidt, K. K. Baldridge, J. A. Boatz, S. T. Elbert, M. S. Gordon, J. H. Jensen, S. Koseki, N. Matsunage, K. A. Nguyen, S. J. Su, T. L. Windus, together with M. Dupuis and J. A. Montgomery, J. Comput. Chem. 14, 1347 (1993).
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Schmidt, M.W.1
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25
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26844534384
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36549097731
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Frisch, M.J.1
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32
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0000800050
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36
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85033057447
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note
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2ρ=0.044 in both H-bonds.
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