#------------------------------------------------------------------------------ #$Date: 2022-03-16 04:56:31 +0200 (Wed, 16 Mar 2022) $ #$Revision: 273718 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/2/10/89/2108937.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_2108937 _cell_angle_alpha 109.098 _cell_angle_beta 95.734 _cell_angle_gamma 116.967 _cell_length_a 10.0600 _cell_length_b 10.4577 _cell_length_c 10.6104 _exptl_crystal_F_000 444.00 _reflns_d_resolution_high 0.7500 _cod_data_source_file aw50643Isup9.hkl _cod_data_source_block 3I _shelx_title ' P-1 in P-1' _shelx_refln_list_code 4 _shelx_f_calc_maximum 207.54 _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 51.13 54.89 2.29 o 2 0 0 298.23 298.09 7.55 o 3 0 0 2084.99 1917.97 19.65 o 4 0 0 7562.81 7662.53 56.60 o 5 0 0 683.71 661.36 13.22 o 6 0 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