#------------------------------------------------------------------------------ #$Date: 2024-01-20 04:42:15 +0200 (Sat, 20 Jan 2024) $ #$Revision: 289169 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/2/02/30/2023013.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_2023013 _cell_angle_alpha 102.218 _cell_angle_beta 101.893 _cell_angle_gamma 114.695 _cell_length_a 9.6998 _cell_length_b 9.7001 _cell_length_c 10.7194 _exptl_crystal_F_000 608.00 _reflns_d_resolution_high 0.7104 _cod_data_source_file yz20462sup3.hkl _cod_data_source_block 2 _shelx_title ' Giessen in P-1' _shelx_refln_list_code 4 _shelx_f_calc_maximum 287.68 _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 1 0 0 39135.44 38935.46 313.89 o 2 0 0 8199.28 9038.93 77.70 o 3 0 0 40931.75 41577.68 378.39 o 4 0 0 40645.27 40021.02 408.25 o 5 0 0 6920.24 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