# generated using pymatgen data_Ba2Sr2Co(CuO4)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.91885700 _cell_length_b 7.92900000 _cell_length_c 7.93472133 _cell_angle_alpha 89.90755086 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba2Sr2Co(CuO4)3 _chemical_formula_sum 'Ba4 Sr4 Co2 Cu6 O24' _cell_volume 498.20953120 _cell_formula_units_Z 2 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 0.50000000 0.75103200 0.24808800 1.0 Ba Ba1 1 0.50000000 0.24790200 0.24762600 1.0 Ba Ba2 1 0.00000000 0.75221600 0.75169200 1.0 Ba Ba3 1 0.00000000 0.24879100 0.24851800 1.0 Sr Sr4 1 0.50000000 0.75511400 0.75332000 1.0 Sr Sr5 1 0.50000000 0.24557600 0.75228400 1.0 Sr Sr6 1 0.00000000 0.24472200 0.75400500 1.0 Sr Sr7 1 0.00000000 0.75460500 0.24556700 1.0 Co Co8 1 0.25010100 0.49991900 0.50465300 1.0 Co Co9 1 0.74989900 0.49991900 0.50465300 1.0 Cu Cu10 1 0.25001200 0.99993300 0.99974200 1.0 Cu Cu11 1 0.24996100 0.49996600 0.00028800 1.0 Cu Cu12 1 0.24995200 0.99971100 0.50060900 1.0 Cu Cu13 1 0.74998800 0.99993300 0.99974200 1.0 Cu Cu14 1 0.75003900 0.49996600 0.00028800 1.0 Cu Cu15 1 0.75004800 0.99971100 0.50060900 1.0 O O16 1 0.50000000 0.99987600 0.98605200 1.0 O O17 1 0.50000000 0.50019300 0.98493900 1.0 O O18 1 0.50000000 0.00005700 0.51497500 1.0 O O19 1 0.50000000 0.50000100 0.50576100 1.0 O O20 1 0.00000000 0.00127400 0.99575800 1.0 O O21 1 0.00000000 0.49927100 0.99764400 1.0 O O22 1 0.00000000 0.00159300 0.50461100 1.0 O O23 1 0.00000000 0.49921000 0.50460800 1.0 O O24 1 0.25487300 0.00513300 0.74857200 1.0 O O25 1 0.25276900 0.49790400 0.74315400 1.0 O O26 1 0.24395400 0.99366400 0.25158800 1.0 O O27 1 0.24629700 0.50322600 0.25939000 1.0 O O28 1 0.74512700 0.00513300 0.74857200 1.0 O O29 1 0.74723100 0.49790400 0.74315400 1.0 O O30 1 0.75604600 0.99366400 0.25158800 1.0 O O31 1 0.75370300 0.50322600 0.25939000 1.0 O O32 1 0.25112000 0.74818300 0.99621900 1.0 O O33 1 0.24987700 0.25187800 0.98579100 1.0 O O34 1 0.25066700 0.74208500 0.50369700 1.0 O O35 1 0.24981900 0.25768400 0.50857200 1.0 O O36 1 0.74888000 0.74818300 0.99621900 1.0 O O37 1 0.75012300 0.25187800 0.98579100 1.0 O O38 1 0.74933300 0.74208500 0.50369700 1.0 O O39 1 0.75018100 0.25768400 0.50857200 1.0