data_global _amcsd_formula_title 'Al6 O18 Sr9' loop_ _publ_author_name 'Alonso J' 'Rasines I' 'Soubeyroux J' _journal_name_full 'Inorganic Chemistry' _journal_volume 29 _journal_year 1990 _journal_page_first 4768 _journal_page_last 4771 _publ_section_title ; Tristrontium dialuminium hexaoxide: An intricate superstructure of perovskite _cod_database_code 1008450 ; _database_code_amcsd 0016355 _chemical_formula_sum 'Sr3 Al2 O6' _cell_length_a 15.8476 _cell_length_b 15.8476 _cell_length_c 15.8476 _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_volume 3980.068 _exptl_crystal_density_diffrn 4.134 _symmetry_space_group_name_H-M 'P a 3' loop_ _space_group_symop_operation_xyz 'x,y,z' '1/2+z,x,1/2-y' 'z,1/2-x,1/2+y' '1/2-z,1/2+x,y' '-z,-x,-y' '1/2+y,1/2-z,-x' '1/2-y,-z,1/2+x' '-y,1/2+z,1/2-x' 'y,z,x' 'x,1/2-y,1/2+z' '1/2-x,1/2+y,z' '1/2+x,y,1/2-z' '-x,-y,-z' '1/2-z,-x,1/2+y' '-z,1/2+x,1/2-y' '1/2+z,1/2-x,-y' 'z,x,y' '1/2-y,1/2+z,x' '1/2+y,z,1/2-x' 'y,1/2-z,1/2+x' '-y,-z,-x' '-x,1/2+y,1/2-z' '1/2+x,1/2-y,-z' '1/2-x,-y,1/2+z' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z Sr1 0.00000 0.00000 0.00000 Sr2 0.50000 0.00000 0.00000 Sr3 0.25210 0.25210 0.25210 Sr4 0.37650 0.37650 0.37640 Sr5 0.13450 0.37450 0.13320 Sr6 0.37930 0.38520 0.12420 Al1 0.25200 0.01640 0.01840 Al2 0.23920 0.23450 0.00410 O1 0.26310 0.12570 0.00320 O2 0.49300 0.12750 0.24480 O3 0.26970 0.27620 0.10010 O4 0.23520 0.40650 0.28040 O5 0.34580 -0.02610 -0.01880 O6 0.15440 -0.01750 -0.01770