#------------------------------------------------------------------------------ #$Date: 2018-10-19 05:28:22 +0300 (Fri, 19 Oct 2018) $ #$Revision: 211540 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/2/02/12/2021271.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_2021271 _cell_angle_alpha 65.356 _cell_angle_beta 69.658 _cell_angle_gamma 77.922 _cell_length_a 10.4179 _cell_length_b 10.5225 _cell_length_c 10.5988 _exptl_crystal_F_000 748.00 _reflns_d_resolution_high 0.7699 _cod_data_source_file jr3004compound_Isup2.hkl _cod_data_source_block compound_I _shelx_title ' mo_LXT0626_1_1_0m_a.res in P-1' _shelx_refln_list_code 4 _shelx_f_calc_maximum 308.90 _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 0 429.86 473.23 4.19 o 3 0 0 23431.25 22485.33 121.09 o 4 0 0 6950.23 6270.21 36.37 o 5 0 0 3.06 18.04 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