#------------------------------------------------------------------------------ #$Date: 2022-07-23 06:46:14 +0300 (Sat, 23 Jul 2022) $ #$Revision: 276889 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/2/10/90/2109009.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_2109009 _cell_angle_alpha 91.250 _cell_angle_beta 91.505 _cell_angle_gamma 99.452 _cell_length_a 7.1158 _cell_length_b 13.1180 _cell_length_c 14.9298 _exptl_crystal_F_000 520.00 _reflns_d_resolution_high 0.8001 _cod_data_source_file rm50631_methyl_OAsup2.hkl _cod_data_source_block 1_methyl_OA _shelx_title ' o-metyl run in space group P 1' _shelx_refln_list_code 4 _shelx_f_calc_maximum 95.45 _shelx_f_squared_multiplier 1.000 loop_ _space_group_symop_operation_xyz '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 0 -3 -18 57.19 59.47 2.12 o 1 -3 -18 0.19 0.13 0.25 o -1 -2 -18 14.92 13.28 0.97 o 0 -2 -18 82.71 84.78 2.79 o 1 -2 -18 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