#------------------------------------------------------------------------------ #$Date: 2016-06-16 04:31:00 +0300 (Thu, 16 Jun 2016) $ #$Revision: 183499 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/2/02/05/2020527.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_2020527 _cell_angle_alpha 112.213 _cell_angle_beta 101.395 _cell_angle_gamma 95.781 _cell_length_a 8.3754 _cell_length_b 12.6354 _cell_length_c 13.6686 _exptl_crystal_F_000 824.00 _reflns_d_resolution_high 0.7484 _cod_data_source_file lg3189Isup2.hkl _cod_data_source_block I _shelx_title ' VS335B_a.res in P-1' _shelx_refln_list_code 4 _shelx_f_calc_maximum 279.17 _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 1427.25 1425.69 32.95 o 2 0 0 48880.02 45145.07 1080.74 o 3 0 0 3873.25 4008.72 60.23 o 4 0 0 9044.69 9126.53 122.44 o 5 0 0 252.28 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