#------------------------------------------------------------------------------ #$Date: 2023-05-25 05:03:52 +0300 (Thu, 25 May 2023) $ #$Revision: 283999 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/2/31/21/2312114.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_2312114 _cell_angle_alpha 113.144 _cell_angle_beta 91.133 _cell_angle_gamma 105.501 _cell_length_a 8.4027 _cell_length_b 12.8657 _cell_length_c 14.4266 _exptl_crystal_F_000 572.00 _reflns_d_resolution_high 0.7570 _cod_data_source_file su5447Isup2.hkl _cod_data_source_block I _shelx_title ' Mo in P-1' _shelx_refln_list_code 4 _shelx_f_calc_maximum 228.00 _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 9607.60 10201.71 84.10 o 2 0 0 1363.34 1364.66 16.46 o 3 0 0 4537.49 4243.77 36.05 o 4 0 0 7915.70 8192.62 62.64 o 5 0 0 1887.67 1977.69 28.04 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