#------------------------------------------------------------------------------ #$Date: 2017-03-02 07:37:17 +0200 (Thu, 02 Mar 2017) $ #$Revision: 192753 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/2/24/20/2242038.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_2242038 _cell_angle_alpha 76.583 _cell_angle_beta 83.238 _cell_angle_gamma 85.777 _cell_length_a 10.1250 _cell_length_b 10.3250 _cell_length_c 17.4190 _exptl_crystal_F_000 732.00 _reflns_d_resolution_high 0.8393 _cod_data_source_file is5467Isup2.hkl _cod_data_source_block I _shelx_title ' 30julbm in P -1' _shelx_refln_list_code 4 _shelx_f_calc_maximum 203.60 _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 23014.81 28584.07 594.95 o 3 0 0 3.63 -3.43 8.58 o 4 0 0 260.02 266.39 17.18 o 5 0 0 2821.13 3135.79 69.58 o 6 0 0 1394.66 1312.75 45.88 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