# generated using pymatgen data_LiMn28O56 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.09989054 _cell_length_b 10.09989054 _cell_length_c 10.09989009 _cell_angle_alpha 99.59292907 _cell_angle_beta 99.59292907 _cell_angle_gamma 99.59292896 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiMn28O56 _chemical_formula_sum 'Li1 Mn28 O56' _cell_volume 981.42386595 _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 Li Li0 1 0.48216500 0.48216500 0.48216500 1.0 Mn Mn1 1 0.00044500 0.64278300 0.42863000 1.0 Mn Mn2 1 0.42822800 0.99966500 0.14250800 1.0 Mn Mn3 1 0.14259700 0.92859400 0.99994600 1.0 Mn Mn4 1 0.28540500 0.71561700 0.57221600 1.0 Mn Mn5 1 0.85731500 0.85749700 0.35694400 1.0 Mn Mn6 1 0.35694400 0.85731500 0.85749700 1.0 Mn Mn7 1 0.78714900 0.71523000 0.57142400 1.0 Mn Mn8 1 0.14145500 0.42785400 0.50028500 1.0 Mn Mn9 1 0.92859400 0.99994600 0.14259700 1.0 Mn Mn10 1 0.42863000 0.00044500 0.64278300 1.0 Mn Mn11 1 0.21339900 0.57171300 0.28443300 1.0 Mn Mn12 1 0.28556600 0.71465800 0.07121800 1.0 Mn Mn13 1 0.85720900 0.85720900 0.85720900 1.0 Mn Mn14 1 0.99966500 0.14250800 0.42822800 1.0 Mn Mn15 1 0.71561700 0.57221600 0.28540500 1.0 Mn Mn16 1 0.28443300 0.21339900 0.57171300 1.0 Mn Mn17 1 0.57142400 0.78714900 0.71523000 1.0 Mn Mn18 1 0.14250800 0.42822800 0.99966500 1.0 Mn Mn19 1 0.42785400 0.50028500 0.14145500 1.0 Mn Mn20 1 0.71523000 0.57142400 0.78714900 1.0 Mn Mn21 1 0.99994600 0.14259700 0.92859400 1.0 Mn Mn22 1 0.50028500 0.14145500 0.42785400 1.0 Mn Mn23 1 0.07121800 0.28556600 0.71465800 1.0 Mn Mn24 1 0.57171300 0.28443300 0.21339900 1.0 Mn Mn25 1 0.64278300 0.42863000 0.00044500 1.0 Mn Mn26 1 0.57221600 0.28540500 0.71561700 1.0 Mn Mn27 1 0.85749700 0.35694400 0.85731500 1.0 Mn Mn28 1 0.71465800 0.07121800 0.28556600 1.0 O O29 1 0.01681100 0.97045400 0.31936500 1.0 O O30 1 0.94985200 0.80700100 0.52139700 1.0 O O31 1 0.96636000 0.84027200 0.02943800 1.0 O O32 1 0.02943800 0.96636000 0.84027200 1.0 O O33 1 0.53776200 0.98285000 0.31534600 1.0 O O34 1 0.45790900 0.82342700 0.55481900 1.0 O O35 1 0.11348300 0.60502200 0.58824000 1.0 O O36 1 0.25633700 0.89076100 0.15972700 1.0 O O37 1 0.17636700 0.73106100 0.39917500 1.0 O O38 1 0.30466600 0.54131100 0.46244200 1.0 O O39 1 0.05046600 0.47898100 0.33619500 1.0 O O40 1 0.19328000 0.76452200 0.90755900 1.0 O O41 1 0.62022600 0.62022600 0.62022600 1.0 O O42 1 0.44545700 0.82779100 0.03368800 1.0 O O43 1 0.76452200 0.90755900 0.19328000 1.0 O O44 1 0.12561800 0.60097900 0.10934100 1.0 O O45 1 0.98285000 0.31534600 0.53776200 1.0 O O46 1 0.69766000 0.74353100 0.39503200 1.0 O O47 1 0.37800200 0.66363000 0.23521100 1.0 O O48 1 0.52139700 0.94985200 0.80700100 1.0 O O49 1 0.26844600 0.88658800 0.68052200 1.0 O O50 1 0.25224700 0.41201300 0.17231500 1.0 O O51 1 0.31534600 0.53776200 0.98285000 1.0 O O52 1 0.10934100 0.12561800 0.60097900 1.0 O O53 1 0.82342700 0.55481900 0.45790900 1.0 O O54 1 0.88658800 0.68052200 0.26844600 1.0 O O55 1 0.17231500 0.25224700 0.41201300 1.0 O O56 1 0.39503200 0.69766000 0.74353100 1.0 O O57 1 0.68480200 0.74785400 0.87390500 1.0 O O58 1 0.74785400 0.87390500 0.68480200 1.0 O O59 1 0.97045400 0.31936500 0.01681100 1.0 O O60 1 0.03368800 0.44545700 0.82779100 1.0 O O61 1 0.60502200 0.58824000 0.11348300 1.0 O O62 1 0.54131100 0.46244200 0.30466600 1.0 O O63 1 0.46244200 0.30466600 0.54131100 1.0 O O64 1 0.87390500 0.68480200 0.74785400 1.0 O O65 1 0.15972700 0.25633700 0.89076100 1.0 O O66 1 0.47898100 0.33619500 0.05046600 1.0 O O67 1 0.73106100 0.39917500 0.17636700 1.0 O O68 1 0.33619500 0.05046600 0.47898100 1.0 O O69 1 0.58824000 0.11348300 0.60502200 1.0 O O70 1 0.80700100 0.52139700 0.94985200 1.0 O O71 1 0.66363000 0.23521100 0.37800200 1.0 O O72 1 0.23521100 0.37800200 0.66363000 1.0 O O73 1 0.09246400 0.09246400 0.09246400 1.0 O O74 1 0.41201300 0.17231500 0.25224700 1.0 O O75 1 0.55481900 0.45790900 0.82342700 1.0 O O76 1 0.60097900 0.10934100 0.12561800 1.0 O O77 1 0.68052200 0.26844600 0.88658800 1.0 O O78 1 0.74353100 0.39503200 0.69766000 1.0 O O79 1 0.82779100 0.03368800 0.44545700 1.0 O O80 1 0.31936500 0.01681100 0.97045400 1.0 O O81 1 0.89076100 0.15972700 0.25633700 1.0 O O82 1 0.39917500 0.17636700 0.73106100 1.0 O O83 1 0.90755900 0.19328000 0.76452200 1.0 O O84 1 0.84027200 0.02943800 0.96636000 1.0