# generated using pymatgen data_BaSr7Mn2(FeO4)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.86751197 _cell_length_b 7.86751197 _cell_length_c 7.82907900 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.01789987 _symmetry_Int_Tables_number 1 _chemical_formula_structural BaSr7Mn2(FeO4)6 _chemical_formula_sum 'Ba1 Sr7 Mn2 Fe6 O24' _cell_volume 484.60230922 _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 Ba Ba0 1 0.74930500 0.74930500 0.50000000 1.0 Sr Sr1 1 0.74921300 0.25072900 0.50000000 1.0 Sr Sr2 1 0.25079300 0.25079300 0.50000000 1.0 Sr Sr3 1 0.25072900 0.74921300 0.50000000 1.0 Sr Sr4 1 0.74928100 0.25079200 0.00000000 1.0 Sr Sr5 1 0.25079600 0.25079600 0.00000000 1.0 Sr Sr6 1 0.74918400 0.74918400 0.00000000 1.0 Sr Sr7 1 0.25079200 0.74928100 0.00000000 1.0 Mn Mn8 1 0.49912800 0.49912800 0.75100800 1.0 Mn Mn9 1 0.49912800 0.49912800 0.24899200 1.0 Fe Fe10 1 0.00116100 0.00116100 0.75101800 1.0 Fe Fe11 1 0.49896400 0.00130600 0.75102000 1.0 Fe Fe12 1 0.00130600 0.49896400 0.75102000 1.0 Fe Fe13 1 0.00116100 0.00116100 0.24898200 1.0 Fe Fe14 1 0.49896400 0.00130600 0.24898000 1.0 Fe Fe15 1 0.00130600 0.49896400 0.24898000 1.0 O O16 1 0.00410100 0.00410100 0.50000000 1.0 O O17 1 0.49594900 0.00407100 0.50000000 1.0 O O18 1 0.00407100 0.49594900 0.50000000 1.0 O O19 1 0.49534600 0.49534600 0.50000000 1.0 O O20 1 0.00123900 0.00123900 0.00000000 1.0 O O21 1 0.49879800 0.00114900 0.00000000 1.0 O O22 1 0.00114900 0.49879800 0.00000000 1.0 O O23 1 0.49896100 0.49896100 0.00000000 1.0 O O24 1 0.00128800 0.25002700 0.75122700 1.0 O O25 1 0.49913300 0.25285400 0.75123300 1.0 O O26 1 0.00411900 0.75001700 0.75418200 1.0 O O27 1 0.49527800 0.74687100 0.75427400 1.0 O O28 1 0.00128800 0.25002700 0.24877300 1.0 O O29 1 0.49913300 0.25285400 0.24876700 1.0 O O30 1 0.00411900 0.75001700 0.24581800 1.0 O O31 1 0.49527800 0.74687100 0.24572600 1.0 O O32 1 0.75001700 0.00411900 0.75418200 1.0 O O33 1 0.25002700 0.00128800 0.75122700 1.0 O O34 1 0.74687100 0.49527800 0.75427400 1.0 O O35 1 0.25285400 0.49913300 0.75123300 1.0 O O36 1 0.75001700 0.00411900 0.24581800 1.0 O O37 1 0.25002700 0.00128800 0.24877300 1.0 O O38 1 0.74687100 0.49527800 0.24572600 1.0 O O39 1 0.25285400 0.49913300 0.24876700 1.0