# generated using pymatgen data_Sr6Ca2Co5(CuO8)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.82215600 _cell_length_b 7.61789100 _cell_length_c 7.75283745 _cell_angle_alpha 89.95441664 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sr6Ca2Co5(CuO8)3 _chemical_formula_sum 'Sr6 Ca2 Co5 Cu3 O24' _cell_volume 461.97850432 _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 Sr Sr0 1 0.24660600 0.24928000 0.24939100 1.0 Sr Sr1 1 0.24669100 0.24920400 0.75065800 1.0 Sr Sr2 1 0.75308800 0.24899500 0.75062200 1.0 Sr Sr3 1 0.24669100 0.75079600 0.24934200 1.0 Sr Sr4 1 0.24660600 0.75072000 0.75060900 1.0 Sr Sr5 1 0.75308800 0.75100500 0.24937800 1.0 Ca Ca6 1 0.75561700 0.24899000 0.24870600 1.0 Ca Ca7 1 0.75561700 0.75101000 0.75129400 1.0 Co Co8 1 0.50292400 0.00000000 0.50000000 1.0 Co Co9 1 0.99837500 0.50000000 0.00000000 1.0 Co Co10 1 0.99865600 0.50000000 0.50000000 1.0 Co Co11 1 0.50147000 0.50000000 0.00000000 1.0 Co Co12 1 0.50163000 0.50000000 0.50000000 1.0 Cu Cu13 1 0.99938600 0.00000000 0.00000000 1.0 Cu Cu14 1 0.00012500 0.00000000 0.50000000 1.0 Cu Cu15 1 0.50102600 0.00000000 0.00000000 1.0 O O16 1 0.99590000 0.25809400 0.00262000 1.0 O O17 1 0.99609200 0.25741400 0.49750600 1.0 O O18 1 0.50396100 0.26081800 0.00258600 1.0 O O19 1 0.50338300 0.24059100 0.49888700 1.0 O O20 1 0.99590000 0.74190600 0.99738000 1.0 O O21 1 0.99609200 0.74258600 0.50249400 1.0 O O22 1 0.50396100 0.73918200 0.99741400 1.0 O O23 1 0.50338300 0.75940900 0.50111300 1.0 O O24 1 0.25060300 0.00000000 0.00000000 1.0 O O25 1 0.24943300 0.00000000 0.50000000 1.0 O O26 1 0.74954700 0.00000000 0.00000000 1.0 O O27 1 0.75154000 0.00000000 0.50000000 1.0 O O28 1 0.24983400 0.50000000 0.00000000 1.0 O O29 1 0.25075500 0.50000000 0.50000000 1.0 O O30 1 0.74993400 0.50000000 0.00000000 1.0 O O31 1 0.74945900 0.50000000 0.50000000 1.0 O O32 1 0.99319800 0.00484700 0.25019200 1.0 O O33 1 0.99319800 0.99515300 0.74980800 1.0 O O34 1 0.50459000 0.00322100 0.25054500 1.0 O O35 1 0.50459000 0.99677900 0.74945500 1.0 O O36 1 0.99475700 0.49778400 0.24956300 1.0 O O37 1 0.99475700 0.50221600 0.75043700 1.0 O O38 1 0.50376800 0.49785200 0.26564100 1.0 O O39 1 0.50376800 0.50214800 0.73435900 1.0