#------------------------------------------------------------------------------ #$Date: 2020-07-18 03:03:52 +0300 (Sat, 18 Jul 2020) $ #$Revision: 254399 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/1/55/86/1558621.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_1558621 _cell_angle_alpha 90.000 _cell_angle_beta 90.000 _cell_angle_gamma 120.000 _cell_length_a 23.6627 _cell_length_b 23.6627 _cell_length_c 10.9815 _exptl_crystal_F_000 2208.00 _reflns_d_resolution_high 0.7799 _cod_data_source_file pk4027Isup3.hkl _cod_data_source_block I _shelx_title ' JPD819_0m_a.res in P31c' _shelx_refln_list_code 4 _shelx_f_calc_maximum 500.07 _shelx_f_squared_multiplier 1.000 loop_ _space_group_symop_operation_xyz 'x, y, z' '-y, x-y, z' '-x+y, -x, z' 'y, x, z+1/2' 'x-y, -y, z+1/2' '-x, -x+y, z+1/2' 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 1 -14 967.69 1260.08 191.12 o 0 2 -14 108.53 188.44 116.07 o 0 1 -13 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