data_global _chemical_name_mineral 'Malladrite' loop_ _publ_author_name 'Zalkin A' 'Forrester J D' 'Templeton D H' _journal_name_full 'Acta Crystallographica' _journal_volume 17 _journal_year 1964 _journal_page_first 1408 _journal_page_last 1412 _publ_section_title ; The crystal structure of sodium fluorosilicate ; _database_code_amcsd 0009291 _chemical_compound_source 'Synthetic' _chemical_formula_sum 'Na2 Si F6' _cell_length_a 8.859 _cell_length_b 8.859 _cell_length_c 5.038 _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 120 _cell_volume 342.419 _exptl_crystal_density_diffrn 2.736 _symmetry_space_group_name_H-M 'P 3 2 1' loop_ _space_group_symop_operation_xyz 'x,y,z' 'y,x,-z' '-y,x-y,z' '-x,-x+y,-z' '-x+y,-x,z' 'x-y,-y,-z' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z Na1 0.37900 0.37900 0.00000 Na2 0.71430 0.71430 0.50000 Si1 0.00000 0.00000 0.00000 Si2 0.33333 0.66667 0.50620 F1 0.08700 -0.09200 0.80990 F2 0.44420 -0.40100 0.70070 F3 0.22990 -0.26000 0.30980 loop_ _atom_site_aniso_label _atom_site_aniso_U_11 _atom_site_aniso_U_22 _atom_site_aniso_U_33 _atom_site_aniso_U_12 _atom_site_aniso_U_13 _atom_site_aniso_U_23 Na1 0.03040 0.03040 0.01647 0.01140 0.00127 -0.00127 Na2 0.02027 0.02027 0.03166 0.00887 -0.00127 0.00127 Si1 0.01646 0.01646 0.02406 0.00760 0.00000 0.00000 Si2 0.01393 0.01393 0.01647 0.00633 0.00000 0.00000 F1 0.00456 0.03420 0.03926 0.02660 0.01140 -0.00507 F2 0.02027 0.02406 0.02913 0.01520 0.00633 0.01646 F3 0.02406 0.03166 0.02913 0.01646 -0.00507 -0.00253