#------------------------------------------------------------------------------ #$Date: 2019-03-12 05:32:01 +0200 (Tue, 12 Mar 2019) $ #$Revision: 214086 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/2/02/15/2021537.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_2021537 _cell_angle_alpha 68.213 _cell_angle_beta 74.653 _cell_angle_gamma 70.552 _cell_length_a 9.8834 _cell_length_b 12.8376 _cell_length_c 14.8324 _exptl_crystal_F_000 768.00 _reflns_d_resolution_high 0.7828 _cod_data_source_file wm54892sup3.hkl _cod_data_source_block 2 _shelx_title ' shelxt_a.res in P-1' _shelx_refln_list_code 4 _shelx_f_calc_maximum 187.87 _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 2 0 0 340.46 291.67 6.26 o 3 0 0 7042.81 7058.75 77.13 o 4 0 0 2554.29 2503.54 31.34 o 5 0 0 500.04 474.96 16.35 o 6 0 0 5544.08 5499.64 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