#------------------------------------------------------------------------------ #$Date: 2017-01-24 03:56:28 +0200 (Tue, 24 Jan 2017) $ #$Revision: 190859 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/2/10/80/2108028.hkl $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/. The original data for this entry # were provided by IUCr Journals, http://journals.iucr.org/. # # The file may be used within the scientific community so long as # proper attribution is given to the journal article from which the # data were obtained. # data_2108028 _chemical_formula_sum 'Fe2 O3' _chemical_formula_weight 159.7 _chemical_name_common hematite _symmetry_cell_setting monoclinic _symmetry_Int_Tables_number 15 _symmetry_space_group_name_Hall '-C 2yc' _symmetry_space_group_name_H-M 'C 1 2/c 1' _cell_angle_alpha 90 _cell_angle_beta 162.3508(2) _cell_angle_gamma 90 _cell_formula_units_Z 4 _cell_length_a 9.68920(8) _cell_length_b 5.08737(2) _cell_length_c 13.84868(11) _cell_measurement_temperature 1053 _cell_volume 206.967(4) _exptl_crystal_density_diffrn 5.1249 _exptl_crystal_F_000 304 _cod_data_source_file dq5016IIsup3.hkl _cod_data_source_block II loop_ _refln_index_h _refln_index_k _refln_index_l _refln_F_squared_calc _refln_F_squared_meas _refln_F_squared_sigma 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5.92 o 1.653340 -3 1 2 512.76 565.98 17.91 o 1.619362 0 2 2 731.68 808.99 25.47 o 1.619141 -1 3 2 645.37 713.54 22.50 o 1.619063 -6 0 8 5392.76 5653.76 130.71 o 1.611341 -5 1 8 5095.40 5345.76 123.51 o 1.611125 -4 2 4 10137.36 10663.48 224.69 o 1.500882 -1 1 4 10949.11 11532.46 242.86 o 1.500711 -3 3 4 10476.58 11034.76 232.44 o 1.500704 -4 2 7 3.12 2.63 0.16 o 1.471863 2 0 0 20772.63 20993.09 442.36 o 1.468824 1 3 0 21452.04 21665.74 456.39 o 1.468654 -5 1 5 144.70 140.22 17.29 o 1.427436 -2 2 5 101.27 98.34 12.10 o 1.427136 -3 3 5 63.03 61.20 7.53 o 1.427132 -3 3 3 0.44 13.56 12.26 < 1.399577 -1 3 3 0.45 14.02 12.67 < 1.399484 -6 2 8 2746.55 2925.97 82.65 o 1.361209 -4 0 8 2579.25 2753.20 77.96 o 1.361039 -7 1 10 9284.84 9687.21 219.75 o 1.321187 -6 0 10 9467.70 9863.81 223.82 o 1.321070 -7 1 9 795.74 693.86 24.67 o 1.316748 -6 2 9 855.52 747.86 26.52 o 1.316590 -5 1 9 802.06 699.31 24.92 o 1.316514 -6 2 7 77.54 68.61 6.77 o 1.274176 -5 3 7 47.27 43.17 3.92 o 1.274032 -3 1 7 101.92 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