data_global _chemical_name_mineral 'Diaoyudaoite' loop_ _publ_author_name 'Beevers C' 'Ross M' _journal_name_full 'Zeitschrift fur Kristallographie' _journal_volume 97 _journal_year 1937 _journal_page_first 59 _journal_page_last 66 _publ_section_title ; The crystal structure of beta alumina Na2O(Al2O3)11 _cod_database_code 1010017 ; _database_code_amcsd 0016956 _chemical_formula_sum 'Na Al11 O17' _cell_length_a 5.584 _cell_length_b 5.584 _cell_length_c 22.45 _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 120 _cell_volume 606.231 _exptl_crystal_density_diffrn 3.242 _symmetry_space_group_name_H-M 'P 63/m m c' loop_ _space_group_symop_operation_xyz 'x,y,z' '-x,-x+y,1/2+z' 'x,x-y,1/2-z' '-x+y,-x,1/2-z' 'x-y,x,1/2+z' '-y,-x,z' 'y,x,-z' 'y,-x+y,-z' '-y,x-y,z' 'x-y,-y,1/2+z' '-x+y,y,1/2-z' 'x,y,1/2-z' '-x,-y,1/2+z' 'x,x-y,z' '-x,-x+y,-z' 'x-y,x,-z' '-x+y,-x,z' 'y,x,1/2+z' '-y,-x,1/2-z' '-y,x-y,1/2-z' 'y,-x+y,1/2+z' '-x+y,y,z' 'x-y,-y,-z' '-x,-y,-z' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z Na1 0.66667 0.33333 0.25000 Al1 0.00000 0.00000 0.00000 Al2 0.33333 0.66667 0.02200 Al3 0.33333 0.16667 0.10600 Al4 0.33333 0.66667 0.17800 O1 0.16667 0.33333 0.05000 O2 0.66667 0.33333 0.05000 O3 0.00000 0.00000 0.14400 O4 0.50000 0.50000 0.14400 O5 0.33333 0.66667 0.25000