#------------------------------------------------------------------------------ #$Date: 2016-12-10 04:31:09 +0200 (Sat, 10 Dec 2016) $ #$Revision: 189039 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/1/54/47/1544768.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_1544768 _cell_angle_alpha 81.913 _cell_angle_beta 86.409 _cell_angle_gamma 78.801 _cell_length_a 7.2438 _cell_length_b 13.9980 _cell_length_c 20.1035 _exptl_crystal_F_000 1232.00 _reflns_d_resolution_high 0.7586 _cod_data_source_file su4106Isup2.hkl _cod_data_source_block I _shelx_title ' c8snme2 in P-1' _shelx_refln_list_code 4 _shelx_f_calc_maximum 764.37 _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 16494.68 16270.09 145.23 o 2 0 0 81500.50 78908.52 809.54 o 3 0 0 279.97 707.58 46.50 o 4 0 0 21874.30 24917.34 454.87 o 5 0 0 2792.36 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