# generated using pymatgen data_Sr6Ca2Fe7CoO24 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.78395958 _cell_length_b 7.78395958 _cell_length_c 7.74663200 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.02191236 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sr6Ca2Fe7CoO24 _chemical_formula_sum 'Sr6 Ca2 Fe7 Co1 O24' _cell_volume 469.36860523 _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 0.74994600 0.25005400 0.25195000 1.0 Sr Sr1 1 0.25005500 0.25005500 0.25193700 1.0 Sr Sr2 1 0.25009200 0.25009200 0.74818700 1.0 Sr Sr3 1 0.74994500 0.74994500 0.25193700 1.0 Sr Sr4 1 0.25005400 0.74994600 0.25195000 1.0 Sr Sr5 1 0.74990800 0.74990800 0.74818700 1.0 Ca Ca6 1 0.75026100 0.24973900 0.74758100 1.0 Ca Ca7 1 0.24973900 0.75026100 0.74758100 1.0 Fe Fe8 1 0.00000000 0.50000000 0.99875100 1.0 Fe Fe9 1 0.50000000 0.50000000 0.99770700 1.0 Fe Fe10 1 0.00000000 0.50000000 0.50117200 1.0 Fe Fe11 1 0.00000000 0.00000000 0.99879200 1.0 Fe Fe12 1 0.50000000 0.00000000 0.99875100 1.0 Fe Fe13 1 0.00000000 0.00000000 0.50141600 1.0 Fe Fe14 1 0.50000000 0.00000000 0.50117200 1.0 Co Co15 1 0.50000000 0.50000000 0.50113300 1.0 O O16 1 0.99806800 0.24958100 0.99671100 1.0 O O17 1 0.50177100 0.25317900 0.99670900 1.0 O O18 1 0.99809300 0.24938100 0.50334700 1.0 O O19 1 0.50250600 0.25144400 0.50353100 1.0 O O20 1 0.00193200 0.75041900 0.99671100 1.0 O O21 1 0.49822900 0.74682100 0.99670900 1.0 O O22 1 0.00190700 0.75061900 0.50334700 1.0 O O23 1 0.49749400 0.74855600 0.50353100 1.0 O O24 1 0.00000000 0.50000000 0.25011700 1.0 O O25 1 0.50000000 0.50000000 0.26343800 1.0 O O26 1 0.00000000 0.50000000 0.74989700 1.0 O O27 1 0.50000000 0.50000000 0.73722000 1.0 O O28 1 0.00000000 0.00000000 0.24900800 1.0 O O29 1 0.50000000 0.00000000 0.25011700 1.0 O O30 1 0.00000000 0.00000000 0.75091400 1.0 O O31 1 0.50000000 0.00000000 0.74989700 1.0 O O32 1 0.74682100 0.49822900 0.99670900 1.0 O O33 1 0.25317900 0.50177100 0.99670900 1.0 O O34 1 0.74855600 0.49749400 0.50353100 1.0 O O35 1 0.25144400 0.50250600 0.50353100 1.0 O O36 1 0.75041900 0.00193200 0.99671100 1.0 O O37 1 0.24958100 0.99806800 0.99671100 1.0 O O38 1 0.75061900 0.00190700 0.50334700 1.0 O O39 1 0.24938100 0.99809300 0.50334700 1.0