# generated using pymatgen data_Sr6Ca2Co7CuO24 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.69613610 _cell_length_b 7.69613610 _cell_length_c 7.71022000 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.01116017 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sr6Ca2Co7CuO24 _chemical_formula_sum 'Sr6 Ca2 Co7 Cu1 O24' _cell_volume 456.68026095 _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 0.24955800 0.75044200 0.75131200 1.0 Sr Sr1 1 0.75058000 0.75058000 0.75119300 1.0 Sr Sr2 1 0.75065700 0.75065700 0.24882400 1.0 Sr Sr3 1 0.24942000 0.24942000 0.75119300 1.0 Sr Sr4 1 0.75044200 0.24955800 0.75131200 1.0 Sr Sr5 1 0.24934300 0.24934300 0.24882400 1.0 Ca Ca6 1 0.24932900 0.75067100 0.24823400 1.0 Ca Ca7 1 0.75067100 0.24932900 0.24823400 1.0 Co Co8 1 0.50000000 0.00000000 0.00112500 1.0 Co Co9 1 0.00000000 0.00000000 0.49875500 1.0 Co Co10 1 0.50000000 0.00000000 0.49900100 1.0 Co Co11 1 0.00000000 0.50000000 0.00112500 1.0 Co Co12 1 0.50000000 0.50000000 0.00074400 1.0 Co Co13 1 0.00000000 0.50000000 0.49900100 1.0 Co Co14 1 0.50000000 0.50000000 0.49854600 1.0 Cu Cu15 1 0.00000000 0.00000000 0.00074700 1.0 O O16 1 0.00249500 0.74610600 0.00320100 1.0 O O17 1 0.49806500 0.74818500 0.00315700 1.0 O O18 1 0.00240400 0.74690800 0.49694200 1.0 O O19 1 0.49892100 0.74992900 0.49721700 1.0 O O20 1 0.99750500 0.25389400 0.00320100 1.0 O O21 1 0.50193500 0.25181500 0.00315700 1.0 O O22 1 0.99759600 0.25309200 0.49694200 1.0 O O23 1 0.50107900 0.25007100 0.49721700 1.0 O O24 1 0.00000000 0.00000000 0.74550800 1.0 O O25 1 0.50000000 0.00000000 0.74720600 1.0 O O26 1 0.00000000 0.00000000 0.25363000 1.0 O O27 1 0.50000000 0.00000000 0.25270000 1.0 O O28 1 0.00000000 0.50000000 0.74720600 1.0 O O29 1 0.50000000 0.50000000 0.75532800 1.0 O O30 1 0.00000000 0.50000000 0.25270000 1.0 O O31 1 0.50000000 0.50000000 0.24548700 1.0 O O32 1 0.25389400 0.99750500 0.00320100 1.0 O O33 1 0.74610600 0.00249500 0.00320100 1.0 O O34 1 0.25309200 0.99759600 0.49694200 1.0 O O35 1 0.74690800 0.00240400 0.49694200 1.0 O O36 1 0.25181500 0.50193500 0.00315700 1.0 O O37 1 0.74818500 0.49806500 0.00315700 1.0 O O38 1 0.25007100 0.50107900 0.49721700 1.0 O O39 1 0.74992900 0.49892100 0.49721700 1.0