data_global _amcsd_formula_title 'Ba Cs4 O18 P6' loop_ _publ_author_name 'Averbuch-Pouchot M' 'Durif A' _journal_name_full 'Acta Crystallographica, Section C' _journal_volume 42 _journal_year 1986 _journal_page_first 928 _journal_page_last 930 _publ_section_title ; Structure of monobarium tetracaesium polyphosphate _cod_database_code 1007248 ; _database_code_amcsd 0015930 _chemical_formula_sum 'Ba Cs4 P6 O18' _cell_length_a 11.549 _cell_length_b 11.549 _cell_length_c 9.114 _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 120 _cell_volume 1052.758 _exptl_crystal_density_diffrn 3.605 _symmetry_space_group_name_H-M 'P 3 1 c' loop_ _space_group_symop_operation_xyz 'x,y,z' 'x-y,-y,1/2+z' '-y,x-y,z' 'y,x,1/2+z' '-x+y,-x,z' '-x,-x+y,1/2+z' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z Ba1 0.33333 0.66667 0.75920 Cs1 0.33333 0.66667 0.25000 Cs2 0.23540 0.00690 0.50660 P1 0.55030 0.00570 0.00060 P2 0.30820 0.28470 0.25100 O1 0.54600 0.12000 0.04500 O2 0.45100 0.58000 -0.02400 O3 0.38200 0.42600 0.33700 O4 0.16200 0.20900 0.27100 O5 0.39200 0.22100 0.26700 O6 0.34600 0.31900 0.58600