data_global _amcsd_formula_title 'K2Fe[H(HPO4)2]F2' loop_ _publ_author_name 'Mi J X' 'Wang C X' 'Wei Z B' 'Chen F J' 'Xu C Y' 'Mao S Y' _journal_name_full 'Acta Crystallographica, Section E' _journal_volume 61 _journal_year 2005 _journal_page_first i143 _journal_page_last i145 _publ_section_title ; K2Fe[H(HPO4)2]F2 ; _database_code_amcsd 0010453 _chemical_compound_source 'Synthetic' _chemical_formula_sum 'Fe P2 K2 F2 O8 H4' _cell_length_a 4.7586 _cell_length_b 8.2530 _cell_length_c 10.758 _cell_angle_alpha 90 _cell_angle_beta 92.845 _cell_angle_gamma 90 _cell_volume 421.975 _exptl_crystal_density_diffrn 2.881 _symmetry_space_group_name_H-M 'P 1 21/c 1' loop_ _space_group_symop_operation_xyz 'x,y,z' 'x,1/2-y,1/2+z' '-x,1/2+y,1/2-z' '-x,-y,-z' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z Fe 0.50000 0.00000 0.00000 P 0.98546 0.75976 0.91368 K 0.50465 0.10069 0.33248 F 0.32270 0.09144 0.85181 O1 0.24450 0.80846 0.98918 O2 0.76820 0.88937 0.89246 O3 0.84890 0.61110 0.96974 O4 0.09460 0.70800 0.78368 H1 -0.02800 0.65720 0.73830 H2 0.94600 0.52610 0.99380