# generated using pymatgen data_KSO4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.63987500 _cell_length_b 10.05342500 _cell_length_c 19.41462900 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural KSO4 _chemical_formula_sum 'K16 S16 O64' _cell_volume 1686.36118509 _cell_formula_units_Z 16 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 0.88191000 0.18001900 0.37460700 1.0 K K1 1 0.38191000 0.31998100 0.62539300 1.0 K K2 1 0.11809000 0.68001900 0.12539300 1.0 K K3 1 0.61809000 0.81998100 0.87460700 1.0 K K4 1 0.11809000 0.81998100 0.62539300 1.0 K K5 1 0.61809000 0.68001900 0.37460700 1.0 K K6 1 0.88191000 0.31998100 0.87460700 1.0 K K7 1 0.38191000 0.18001900 0.12539300 1.0 K K8 1 0.37313500 0.31915900 0.38117000 1.0 K K9 1 0.87313500 0.18084100 0.61883000 1.0 K K10 1 0.62686500 0.81915900 0.11883000 1.0 K K11 1 0.12686500 0.68084100 0.88117000 1.0 K K12 1 0.62686500 0.68084100 0.61883000 1.0 K K13 1 0.12686500 0.81915900 0.38117000 1.0 K K14 1 0.37313500 0.18084100 0.88117000 1.0 K K15 1 0.87313500 0.31915900 0.11883000 1.0 S S16 1 0.75165600 0.42923600 0.49678200 1.0 S S17 1 0.25165600 0.07076400 0.50321800 1.0 S S18 1 0.24834400 0.92923600 0.00321800 1.0 S S19 1 0.74834400 0.57076400 0.99678200 1.0 S S20 1 0.24834400 0.57076400 0.50321800 1.0 S S21 1 0.74834400 0.92923600 0.49678200 1.0 S S22 1 0.75165600 0.07076400 0.99678200 1.0 S S23 1 0.25165600 0.42923600 0.00321800 1.0 S S24 1 0.47569100 0.02134700 0.29238700 1.0 S S25 1 0.97569100 0.47865300 0.70761300 1.0 S S26 1 0.52430900 0.52134700 0.20761300 1.0 S S27 1 0.02430900 0.97865300 0.79238700 1.0 S S28 1 0.52430900 0.97865300 0.70761300 1.0 S S29 1 0.02430900 0.52134700 0.29238700 1.0 S S30 1 0.47569100 0.47865300 0.79238700 1.0 S S31 1 0.97569100 0.02134700 0.20761300 1.0 O O32 1 0.78527600 0.57434900 0.49792100 1.0 O O33 1 0.28527600 0.92565100 0.50207900 1.0 O O34 1 0.21472400 0.07434900 0.00207900 1.0 O O35 1 0.71472400 0.42565100 0.99792100 1.0 O O36 1 0.21472400 0.42565100 0.50207900 1.0 O O37 1 0.71472400 0.07434900 0.49792100 1.0 O O38 1 0.78527600 0.92565100 0.99792100 1.0 O O39 1 0.28527600 0.57434900 0.00207900 1.0 O O40 1 0.89830900 0.35176800 0.49649400 1.0 O O41 1 0.39830900 0.14823200 0.50350600 1.0 O O42 1 0.10169100 0.85176800 0.00350600 1.0 O O43 1 0.60169100 0.64823200 0.99649400 1.0 O O44 1 0.10169100 0.64823200 0.50350600 1.0 O O45 1 0.60169100 0.85176800 0.49649400 1.0 O O46 1 0.89830900 0.14823200 0.99649400 1.0 O O47 1 0.39830900 0.35176800 0.00350600 1.0 O O48 1 0.66323800 0.39584800 0.56031000 1.0 O O49 1 0.16323800 0.10415200 0.43969000 1.0 O O50 1 0.33676200 0.89584800 0.93969000 1.0 O O51 1 0.83676200 0.60415200 0.06031000 1.0 O O52 1 0.33676200 0.60415200 0.43969000 1.0 O O53 1 0.83676200 0.89584800 0.56031000 1.0 O O54 1 0.66323800 0.10415200 0.06031000 1.0 O O55 1 0.16323800 0.39584800 0.93969000 1.0 O O56 1 0.66318500 0.39767500 0.43306400 1.0 O O57 1 0.16318500 0.10232500 0.56693600 1.0 O O58 1 0.33681500 0.89767500 0.06693600 1.0 O O59 1 0.83681500 0.60232500 0.93306400 1.0 O O60 1 0.33681500 0.60232500 0.56693600 1.0 O O61 1 0.83681500 0.89767500 0.43306400 1.0 O O62 1 0.66318500 0.10232500 0.93306400 1.0 O O63 1 0.16318500 0.39767500 0.06693600 1.0 O O64 1 0.56058900 0.99255000 0.22676000 1.0 O O65 1 0.06058900 0.50745000 0.77324000 1.0 O O66 1 0.43941100 0.49255000 0.27324000 1.0 O O67 1 0.93941100 0.00745000 0.72676000 1.0 O O68 1 0.43941100 0.00745000 0.77324000 1.0 O O69 1 0.93941100 0.49255000 0.22676000 1.0 O O70 1 0.56058900 0.50745000 0.72676000 1.0 O O71 1 0.06058900 0.99255000 0.27324000 1.0 O O72 1 0.34069000 0.10967300 0.27779900 1.0 O O73 1 0.84069000 0.39032700 0.72220100 1.0 O O74 1 0.65931000 0.60967300 0.22220100 1.0 O O75 1 0.15931000 0.89032700 0.77779900 1.0 O O76 1 0.65931000 0.89032700 0.72220100 1.0 O O77 1 0.15931000 0.60967300 0.27779900 1.0 O O78 1 0.34069000 0.39032700 0.77779900 1.0 O O79 1 0.84069000 0.10967300 0.22220100 1.0 O O80 1 0.42266600 0.89374200 0.32225200 1.0 O O81 1 0.92266600 0.60625800 0.67774800 1.0 O O82 1 0.57733400 0.39374200 0.17774800 1.0 O O83 1 0.07733400 0.10625800 0.82225200 1.0 O O84 1 0.57733400 0.10625800 0.67774800 1.0 O O85 1 0.07733400 0.39374200 0.32225200 1.0 O O86 1 0.42266600 0.60625800 0.82225200 1.0 O O87 1 0.92266600 0.89374200 0.17774800 1.0 O O88 1 0.58050300 0.09194400 0.34044900 1.0 O O89 1 0.08050300 0.40805600 0.65955100 1.0 O O90 1 0.41949700 0.59194400 0.15955100 1.0 O O91 1 0.91949700 0.90805600 0.84044900 1.0 O O92 1 0.41949700 0.90805600 0.65955100 1.0 O O93 1 0.91949700 0.59194400 0.34044900 1.0 O O94 1 0.58050300 0.40805600 0.84044900 1.0 O O95 1 0.08050300 0.09194400 0.15955100 1.0