#------------------------------------------------------------------------------ #$Date: 2021-07-16 08:08:54 +0300 (Fri, 16 Jul 2021) $ #$Revision: 267585 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/2/10/88/2108836.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_2108836 _cell_angle_alpha 88.188 _cell_angle_beta 89.472 _cell_angle_gamma 73.923 _cell_length_a 8.1178 _cell_length_b 12.0928 _cell_length_c 14.4689 _exptl_crystal_F_000 848.00 _reflns_d_resolution_high 0.7199 _cod_data_source_file xk5079KB02_100Ksup3.hkl _cod_data_source_block KB02_100K _shelx_title ' KB02 100K in P-1' _shelx_refln_list_code 4 _shelx_f_calc_maximum 406.13 _shelx_f_squared_multiplier 1.000 loop_ _space_group_symop_operation_xyz 'x, y, z' '-x, -y, -z' loop_ _refln_index_h _refln_index_k _refln_index_l _refln_F_squared_calc _refln_F_squared_meas _refln_F_squared_sigma _refln_observed_status 0 1 0 3870.60 3601.95 88.04 o -1 2 0 71.82 69.15 11.13 o 0 2 0 66353.19 64673.57 1318.81 o 1 2 0 106.51 104.30 6.75 o -2 3 0 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