# generated using pymatgen data_Ba3Sr5Co2(CuO4)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.87342300 _cell_length_b 7.85403700 _cell_length_c 7.86306911 _cell_angle_alpha 89.96957805 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba3Sr5Co2(CuO4)6 _chemical_formula_sum 'Ba3 Sr5 Co2 Cu6 O24' _cell_volume 486.23762215 _cell_formula_units_Z 1 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Ba Ba0 1 0.00000000 0.24720100 0.75134300 1.0 Ba Ba1 1 0.00000000 0.24745300 0.24818200 1.0 Ba Ba2 1 0.50000000 0.24713000 0.24804600 1.0 Sr Sr3 1 0.00000000 0.75328800 0.75447500 1.0 Sr Sr4 1 0.00000000 0.75276000 0.24609200 1.0 Sr Sr5 1 0.50000000 0.75412900 0.75428300 1.0 Sr Sr6 1 0.50000000 0.75358100 0.24479400 1.0 Sr Sr7 1 0.50000000 0.24547900 0.75347300 1.0 Co Co8 1 0.25140000 0.50598600 0.50198300 1.0 Co Co9 1 0.74860000 0.50598600 0.50198300 1.0 Cu Cu10 1 0.25023100 0.99931400 0.99970600 1.0 Cu Cu11 1 0.25040400 0.00026700 0.50040000 1.0 Cu Cu12 1 0.25010600 0.50046200 0.00011900 1.0 Cu Cu13 1 0.74976900 0.99931400 0.99970600 1.0 Cu Cu14 1 0.74959600 0.00026700 0.50040000 1.0 Cu Cu15 1 0.74989400 0.50046200 0.00011900 1.0 O O16 1 0.00000000 0.98601600 0.99857300 1.0 O O17 1 0.00000000 0.98620400 0.50174400 1.0 O O18 1 0.00000000 0.51512100 0.99922400 1.0 O O19 1 0.00000000 0.50758100 0.50130500 1.0 O O20 1 0.50000000 0.99052100 0.99415300 1.0 O O21 1 0.50000000 0.99165300 0.50659300 1.0 O O22 1 0.50000000 0.51044800 0.99431000 1.0 O O23 1 0.50000000 0.50620500 0.50247500 1.0 O O24 1 0.25221400 0.74884500 0.99821100 1.0 O O25 1 0.25119300 0.74486600 0.50183900 1.0 O O26 1 0.25714600 0.25168700 0.99299900 1.0 O O27 1 0.25425300 0.25820800 0.50432500 1.0 O O28 1 0.74778600 0.74884500 0.99821100 1.0 O O29 1 0.74880700 0.74486600 0.50183900 1.0 O O30 1 0.74285400 0.25168700 0.99299900 1.0 O O31 1 0.74574700 0.25820800 0.50432500 1.0 O O32 1 0.25609400 0.99095600 0.74862300 1.0 O O33 1 0.25162800 0.98598500 0.25135500 1.0 O O34 1 0.25359100 0.50679300 0.74403700 1.0 O O35 1 0.25098100 0.50924500 0.25687100 1.0 O O36 1 0.74390600 0.99095600 0.74862300 1.0 O O37 1 0.74837200 0.98598500 0.25135500 1.0 O O38 1 0.74640900 0.50679300 0.74403700 1.0 O O39 1 0.74901900 0.50924500 0.25687100 1.0