data_global _amcsd_formula_title 'Bi1.72 O3 Sr0.53' loop_ _publ_author_name 'Boivin J' 'Thomas D' _journal_name_full 'Solid State Ionics' _journal_volume 3 _journal_year 1981 _journal_page_first 457 _journal_page_last 462 _publ_section_title ; Structural investigations on bismuth-based oxides _cod_database_code 1004071 ; _database_code_amcsd 0015498 _chemical_formula_sum 'Sr.706 Bi2.295 O4' _cell_length_a 3.971 _cell_length_b 3.971 _cell_length_c 28.41 _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 120 _cell_volume 387.973 _exptl_crystal_density_diffrn 7.774 _symmetry_space_group_name_H-M 'R -3 m' loop_ _space_group_symop_operation_xyz 'x,y,z' '2/3+x,1/3+y,1/3+z' '1/3+x,2/3+y,2/3+z' 'x,x-y,z' '2/3+x,1/3+x-y,1/3+z' '1/3+x,2/3+x-y,2/3+z' 'y,x,-z' '2/3+y,1/3+x,1/3-z' '1/3+y,2/3+x,2/3-z' '-x+y,y,z' '2/3-x+y,1/3+y,1/3+z' '1/3-x+y,2/3+y,2/3+z' '-x,-x+y,-z' '2/3-x,1/3-x+y,1/3-z' '1/3-x,2/3-x+y,2/3-z' '-y,-x,z' '2/3-y,1/3-x,1/3+z' '1/3-y,2/3-x,2/3+z' 'x-y,-y,-z' '2/3+x-y,1/3-y,1/3-z' '1/3+x-y,2/3-y,2/3-z' 'y,-x+y,-z' '2/3+y,1/3-x+y,1/3-z' '1/3+y,2/3-x+y,2/3-z' '-x+y,-x,z' '2/3-x+y,1/3-x,1/3+z' '1/3-x+y,2/3-x,2/3+z' '-x,-y,-z' '2/3-x,1/3-y,1/3-z' '1/3-x,2/3-y,2/3-z' '-y,x-y,z' '2/3-y,1/3+x-y,1/3+z' '1/3-y,2/3+x-y,2/3+z' 'x-y,x,-z' '2/3+x-y,1/3+x,1/3-z' '1/3+x-y,2/3+x,2/3-z' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Sr1 0.00000 0.00000 0.00000 0.70600 Bi1 0.00000 0.00000 0.00000 0.29500 Bi2 0.00000 0.00000 0.22400 1.00000 O1 0.00000 0.00000 0.29460 1.00000 O2 0.00000 0.00000 0.09910 1.00000