# generated using pymatgen data_Na3Mn20O40 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.96712667 _cell_length_b 10.33178285 _cell_length_c 13.31407759 _cell_angle_alpha 75.09345163 _cell_angle_beta 102.98753244 _cell_angle_gamma 106.79474923 _symmetry_Int_Tables_number 1 _chemical_formula_structural Na3Mn20O40 _chemical_formula_sum 'Na3 Mn20 O40' _cell_volume 749.26657635 _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 Na Na0 1 0.00218900 0.37440300 0.12592400 1.0 Na Na1 1 0.79854300 0.77524700 0.32423500 1.0 Na Na2 1 0.19872400 0.22419000 0.67544900 1.0 Mn Mn3 1 0.39826800 0.19642100 0.09872200 1.0 Mn Mn4 1 0.50054700 0.50339000 0.99656600 1.0 Mn Mn5 1 0.20491300 0.10018800 0.30230100 1.0 Mn Mn6 1 0.89829900 0.70423900 0.09601200 1.0 Mn Mn7 1 0.39773500 0.70375600 0.09538800 1.0 Mn Mn8 1 0.69383600 0.09979100 0.30273500 1.0 Mn Mn9 1 0.29839600 0.90302400 0.19607900 1.0 Mn Mn10 1 0.09768700 0.29972100 0.40044600 1.0 Mn Mn11 1 0.99893400 0.99951400 0.50118600 1.0 Mn Mn12 1 0.19914800 0.59944000 0.29997200 1.0 Mn Mn13 1 0.00059100 0.50127600 0.50015500 1.0 Mn Mn14 1 0.50160400 0.50084300 0.49990300 1.0 Mn Mn15 1 0.80335900 0.40492700 0.70120300 1.0 Mn Mn16 1 0.69955400 0.09730900 0.80303300 1.0 Mn Mn17 1 0.90318300 0.70015400 0.60335000 1.0 Mn Mn18 1 0.60231700 0.30071700 0.90019800 1.0 Mn Mn19 1 0.30107400 0.89687300 0.70022200 1.0 Mn Mn20 1 0.10128600 0.30033400 0.89987300 1.0 Mn Mn21 1 0.79548500 0.89603400 0.70068000 1.0 Mn Mn22 1 0.59840900 0.80077200 0.89907800 1.0 O O23 1 0.65454300 0.34589200 0.03769800 1.0 O O24 1 0.23125600 0.34561400 0.03734000 1.0 O O25 1 0.13778200 0.05352700 0.16007700 1.0 O O26 1 0.57418900 0.05308700 0.16045600 1.0 O O27 1 0.59864600 0.56956800 0.13098100 1.0 O O28 1 0.48603700 0.22742300 0.24600700 1.0 O O29 1 0.68497800 0.82891900 0.04527500 1.0 O O30 1 0.11273000 0.57959000 0.15022000 1.0 O O31 1 0.19776300 0.83698200 0.06231500 1.0 O O32 1 0.99786300 0.23054500 0.27113400 1.0 O O33 1 0.82666600 0.14723600 0.44357500 1.0 O O34 1 0.02969900 0.74919300 0.23576700 1.0 O O35 1 0.45298900 0.74890900 0.23523700 1.0 O O36 1 0.25972400 0.14789700 0.44344300 1.0 O O37 1 0.93850300 0.45510300 0.35832400 1.0 O O38 1 0.37093000 0.45407700 0.35750400 1.0 O O39 1 0.39733900 0.96426300 0.33317900 1.0 O O40 1 0.19924700 0.36996200 0.53039000 1.0 O O41 1 0.28802500 0.62874300 0.44488300 1.0 O O42 1 0.08320600 0.02040000 0.64734600 1.0 O O43 1 0.80305000 0.63224200 0.47045900 1.0 O O44 1 0.71489300 0.37372700 0.55526200 1.0 O O45 1 0.91417200 0.97685200 0.35608600 1.0 O O46 1 0.60003800 0.03246700 0.66791300 1.0 O O47 1 0.62815500 0.54693900 0.64191500 1.0 O O48 1 0.06308800 0.54652000 0.64171800 1.0 O O49 1 0.54754900 0.25543600 0.76268200 1.0 O O50 1 0.73936200 0.85015500 0.56010800 1.0 O O51 1 0.96952600 0.25489600 0.76264100 1.0 O O52 1 0.17177000 0.85154900 0.55966200 1.0 O O53 1 0.80304300 0.16820600 0.93602500 1.0 O O54 1 0.89038700 0.42798600 0.84982900 1.0 O O55 1 0.00070100 0.76453700 0.73466100 1.0 O O56 1 0.51171300 0.77164700 0.75356600 1.0 O O57 1 0.40022800 0.43275600 0.86432400 1.0 O O58 1 0.31340300 0.17308400 0.95036000 1.0 O O59 1 0.42482000 0.94591100 0.83993500 1.0 O O60 1 0.85893400 0.94554000 0.84039300 1.0 O O61 1 0.77365300 0.65572600 0.95809000 1.0 O O62 1 0.33779800 0.65492800 0.95764300 1.0