# generated using pymatgen data_Sr2CoO4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.50309445 _cell_length_b 11.00599027 _cell_length_c 6.83872302 _cell_angle_alpha 90.32055684 _cell_angle_beta 66.27827049 _cell_angle_gamma 90.81717466 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sr2CoO4 _chemical_formula_sum 'Sr8 Co4 O16' _cell_volume 379.16658882 _cell_formula_units_Z 4 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 0.35217200 0.50177800 0.28509800 1.0 Sr Sr1 1 0.85851500 0.25043200 0.28258700 1.0 Sr Sr2 1 0.36014900 0.99835900 0.28619400 1.0 Sr Sr3 1 0.85669000 0.74932000 0.28751100 1.0 Sr Sr4 1 0.14298400 0.74918000 0.71306900 1.0 Sr Sr5 1 0.63798000 0.50161600 0.71501800 1.0 Sr Sr6 1 0.14121800 0.25076900 0.71688900 1.0 Sr Sr7 1 0.64659900 0.99831300 0.71357200 1.0 Co Co8 1 0.49869500 0.75016900 0.00022000 1.0 Co Co9 1 0.99876000 0.49815800 0.00011900 1.0 Co Co10 1 0.49841000 0.24940400 0.99971600 1.0 Co Co11 1 0.99791700 0.00239100 0.99985700 1.0 O O12 1 0.15491600 0.49925100 0.68165900 1.0 O O13 1 0.65393500 0.24852500 0.69430800 1.0 O O14 1 0.16215400 0.00208500 0.68274500 1.0 O O15 1 0.66130100 0.75025600 0.68257100 1.0 O O16 1 0.34115300 0.74985100 0.31794800 1.0 O O17 1 0.83852300 0.49928400 0.31848100 1.0 O O18 1 0.34861100 0.24820700 0.30499200 1.0 O O19 1 0.84536700 0.00261800 0.31739400 1.0 O O20 1 0.72608200 0.63511500 0.00079900 1.0 O O21 1 0.25722100 0.36810300 0.99920600 1.0 O O22 1 0.74570100 0.13032000 0.99930500 1.0 O O23 1 0.27404000 0.86529900 0.99961800 1.0 O O24 1 0.22603000 0.61733500 0.99943700 1.0 O O25 1 0.75941000 0.38568500 0.00069400 1.0 O O26 1 0.23913800 0.11542300 0.99960600 1.0 O O27 1 0.77632900 0.88275300 0.00138700 1.0