#------------------------------------------------------------------------------ #$Date: 2018-03-16 08:57:56 +0200 (Fri, 16 Mar 2018) $ #$Revision: 206980 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/2/02/10/2021057.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_2021057 _cell_angle_alpha 90.000 _cell_angle_beta 91.063 _cell_angle_gamma 90.000 _cell_length_a 11.5095 _cell_length_b 12.0788 _cell_length_c 9.5184 _exptl_crystal_F_000 608.00 _reflns_d_resolution_high 0.7336 _cod_data_source_file uk3153Isup2.hkl _cod_data_source_block I _shelx_title ' spiter_lisulf in C c' _shelx_refln_list_code 4 _shelx_f_calc_maximum 192.55 _shelx_f_squared_multiplier 1.000 loop_ _space_group_symop_operation_xyz 'x, y, z' 'x, -y, z+1/2' 'x+1/2, y+1/2, z' 'x+1/2, -y+1/2, z+1/2' 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 -4 0 -12 723.65 732.49 42.70 o -2 0 -12 514.09 584.37 38.30 o 0 0 -12 137.93 116.49 17.13 o 2 0 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