#------------------------------------------------------------------------------ #$Date: 2016-02-13 14:50:18 +0200 (Sat, 13 Feb 2016) $ #$Revision: 176428 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/52/13/1521356.cif $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/ # # All data on this site have been placed in the public domain by the # contributors. # data_1521356 loop_ _publ_author_name 'Kahlenberg, V.' 'Doersam, G.' 'Wendschuh-Josties, M.' 'Fischer, R.X.' _publ_section_title ; The crystal structure of delta-(Na2 Si2 O5) ; _journal_name_full 'Journal of Solid State Chemistry' _journal_page_first 380 _journal_page_last 386 _journal_volume 146 _journal_year 1999 _chemical_formula_sum 'Na2 O5 Si2' _chemical_name_systematic 'Na2 (Si2 O5)' _space_group_IT_number 14 _symmetry_space_group_name_Hall '-P 2yn' _symmetry_space_group_name_H-M 'P 1 21/n 1' _cell_angle_alpha 90 _cell_angle_beta 90.37 _cell_angle_gamma 90 _cell_formula_units_Z 4 _cell_length_a 8.393 _cell_length_b 12.083 _cell_length_c 4.843 _cell_volume 491.131 _citation_journal_id_ASTM JSSCBI _cod_data_source_file Kahlenberg_JSSCBI_1999_272.cif _cod_data_source_block Na2O5Si2 _cod_original_sg_symbol_Hall '-P 2ybc (x-z,y,z)' _cod_database_code 1521356 loop_ _symmetry_equiv_pos_as_xyz x,y,z -x+1/2,y+1/2,-z+1/2 -x,-y,-z x-1/2,-y-1/2,z-1/2 loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy _atom_site_U_iso_or_equiv O1 O-2 0.6356 -0.0546 0.7585 1 0.0 O3 O-2 0.6383 0.7966 0.3662 1 0.0 O5 O-2 0.1396 0.2088 0.2491 1 0.0 Si1 Si+4 0.9492 0.1974 0.3006 1 0.0 Na2 Na+1 0.8804 0.0381 0.7651 1 0.0 Na1 Na+1 0.6303 -0.0025 0.2435 1 0.0 O2 O-2 0.8871 0.0762 0.2503 1 0.0 O4 O-2 0.5747 0.7286 0.8654 1 0.0 Si2 Si+4 0.6764 0.8207 0.7007 1 0.0