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note
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w = 0.104 (all data) for 2107 unique reflections. All of the hydrogen atoms could be found in difference Fourier maps, and their coordinates and isotropic temperature factors were included in the refinement.
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21
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85039635811
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note
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The symmetry operation code of ‡ is 1/2-x, -y, -1/2+z.
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