#------------------------------------------------------------------------------ #$Date: 2016-11-09 04:05:53 +0200 (Wed, 09 Nov 2016) $ #$Revision: 188334 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/2/24/19/2241939.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_2241939 _cell_angle_alpha 80.420 _cell_angle_beta 81.035 _cell_angle_gamma 87.663 _cell_length_a 7.4056 _cell_length_b 9.0416 _cell_length_c 11.7186 _exptl_crystal_F_000 320.00 _reflns_d_resolution_high 0.7700 _cod_data_source_file hb7630Isup2.hkl _cod_data_source_block I _shelx_title ' 05111517' _shelx_refln_list_code 4 _shelx_f_calc_maximum 169.17 _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 2 0 0 0.04 0.22 0.40 o 3 0 0 127.78 120.91 1.59 o 4 0 0 47.61 45.55 0.77 o 5 0 0 73.89 85.31 1.35 o 6 0 0 264.61 269.23 6.86 o 7 0 0 102.69 99.02 2.00 o 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