# generated using pymatgen data_KCr20O40 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.95335700 _cell_length_b 9.95335700 _cell_length_c 10.27674444 _cell_angle_alpha 61.03559922 _cell_angle_beta 61.03559922 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural KCr20O40 _chemical_formula_sum 'K1 Cr20 O40' _cell_volume 741.87512083 _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 K K0 1 0.90000000 0.90000000 0.20000000 1.0 Cr Cr1 1 0.36483100 0.85305600 0.59987000 1.0 Cr Cr2 1 0.76470100 0.25292700 0.80013000 1.0 Cr Cr3 1 0.16456500 0.65263300 0.99993900 1.0 Cr Cr4 1 0.56261300 0.05481300 0.20000000 1.0 Cr Cr5 1 0.96450400 0.45257100 0.40006100 1.0 Cr Cr6 1 0.23738700 0.74518700 0.20000000 1.0 Cr Cr7 1 0.63543500 0.14736700 0.40006100 1.0 Cr Cr8 1 0.03529900 0.54707300 0.59987000 1.0 Cr Cr9 1 0.43516900 0.94694400 0.80013000 1.0 Cr Cr10 1 0.83549600 0.34742900 0.99993900 1.0 Cr Cr11 1 0.45257100 0.63543500 0.40006100 1.0 Cr Cr12 1 0.85305600 0.03529900 0.59987000 1.0 Cr Cr13 1 0.25292700 0.43516900 0.80013000 1.0 Cr Cr14 1 0.65263300 0.83549600 0.99993900 1.0 Cr Cr15 1 0.05481300 0.23738700 0.20000000 1.0 Cr Cr16 1 0.14736700 0.96450400 0.40006100 1.0 Cr Cr17 1 0.54707300 0.36483100 0.59987000 1.0 Cr Cr18 1 0.94694400 0.76470100 0.80013000 1.0 Cr Cr19 1 0.34742900 0.16456500 0.99993900 1.0 Cr Cr20 1 0.74518700 0.56261300 0.20000000 1.0 O O21 1 0.36200500 0.66237200 0.60027100 1.0 O O22 1 0.76227600 0.06264200 0.79972900 1.0 O O23 1 0.16218400 0.46289300 0.99981100 1.0 O O24 1 0.56315700 0.86310900 0.20000000 1.0 O O25 1 0.96199500 0.26270400 0.40018900 1.0 O O26 1 0.23684300 0.93689100 0.20000000 1.0 O O27 1 0.63781600 0.33710700 0.40018900 1.0 O O28 1 0.03772400 0.73735800 0.60027100 1.0 O O29 1 0.43799500 0.13762800 0.79972900 1.0 O O30 1 0.83800500 0.53729600 0.99981100 1.0 O O31 1 0.26270400 0.63781600 0.40018900 1.0 O O32 1 0.66237200 0.03772400 0.60027100 1.0 O O33 1 0.06264200 0.43799500 0.79972900 1.0 O O34 1 0.46289300 0.83800500 0.99981100 1.0 O O35 1 0.86310900 0.23684300 0.20000000 1.0 O O36 1 0.33710700 0.96199500 0.40018900 1.0 O O37 1 0.73735800 0.36200500 0.60027100 1.0 O O38 1 0.13762800 0.76227600 0.79972900 1.0 O O39 1 0.53729600 0.16218400 0.99981100 1.0 O O40 1 0.93689100 0.56315700 0.20000000 1.0 O O41 1 0.00623700 0.64362800 0.39841200 1.0 O O42 1 0.40778100 0.04066200 0.59919900 1.0 O O43 1 0.80698000 0.43986200 0.80080100 1.0 O O44 1 0.20464900 0.84204000 0.00158800 1.0 O O45 1 0.60734500 0.24089700 0.20000000 1.0 O O46 1 0.59535100 0.95796000 0.39841200 1.0 O O47 1 0.99302000 0.36013800 0.59919900 1.0 O O48 1 0.39221900 0.75933800 0.80080100 1.0 O O49 1 0.79376300 0.15637200 0.00158800 1.0 O O50 1 0.19265500 0.55910300 0.20000000 1.0 O O51 1 0.24089700 0.19265500 0.20000000 1.0 O O52 1 0.64362800 0.59535100 0.39841200 1.0 O O53 1 0.04066200 0.99302000 0.59919900 1.0 O O54 1 0.43986200 0.39221900 0.80080100 1.0 O O55 1 0.84204000 0.79376300 0.00158800 1.0 O O56 1 0.36013800 0.40778100 0.59919900 1.0 O O57 1 0.75933800 0.80698000 0.80080100 1.0 O O58 1 0.15637200 0.20464900 0.00158800 1.0 O O59 1 0.55910300 0.60734500 0.20000000 1.0 O O60 1 0.95796000 0.00623700 0.39841200 1.0