#------------------------------------------------------------------------------ #$Date: 2021-07-28 08:23:42 +0300 (Wed, 28 Jul 2021) $ #$Revision: 267783 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/2/10/88/2108854.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_2108854 _cell_angle_alpha 90.000 _cell_angle_beta 90.000 _cell_angle_gamma 90.000 _cell_length_a 4.0367 _cell_length_b 13.4739 _cell_length_c 14.1499 _exptl_crystal_F_000 576.00 _reflns_d_resolution_high 0.8121 _cod_data_source_file lo5092135TBB_200Ksup9.hkl _cod_data_source_block 135TBB_200K _shelx_title ' 135TBB_200K in P2(1)2(1)2(1)' _shelx_refln_list_code 4 _shelx_f_calc_maximum 262.83 _shelx_f_squared_multiplier 1.000 loop_ _space_group_symop_operation_xyz 'x, y, z' '-x+1/2, -y, z+1/2' '-x, y+1/2, -z+1/2' 'x+1/2, -y+1/2, -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 0 501.26 496.66 18.03 o 4 0 0 1177.25 1111.08 60.65 o 1 1 0 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