# generated using pymatgen data_K2LiTi2(AsO5)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.75601400 _cell_length_b 11.05572000 _cell_length_c 13.23673400 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural K2LiTi2(AsO5)2 _chemical_formula_sum 'K8 Li4 Ti8 As8 O40' _cell_volume 988.68606606 _cell_formula_units_Z 4 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 0.61648700 0.08468600 0.09712700 1.0 K K1 1 0.28244800 0.78836100 0.13765600 1.0 K K2 1 0.78244800 0.28836100 0.36234400 1.0 K K3 1 0.11648700 0.58468600 0.40287300 1.0 K K4 1 0.88351300 0.08468600 0.59712700 1.0 K K5 1 0.21755200 0.78836100 0.63765600 1.0 K K6 1 0.71755200 0.28836100 0.86234400 1.0 K K7 1 0.38351300 0.58468600 0.90287300 1.0 Li Li8 1 0.04050700 0.03130000 0.10280200 1.0 Li Li9 1 0.54050700 0.53130000 0.39719800 1.0 Li Li10 1 0.45949300 0.03130000 0.60280200 1.0 Li Li11 1 0.95949300 0.53130000 0.89719800 1.0 Ti Ti12 1 0.00659000 0.51635500 0.13352600 1.0 Ti Ti13 1 0.25938200 0.26741900 0.24838000 1.0 Ti Ti14 1 0.75938200 0.76741900 0.25162000 1.0 Ti Ti15 1 0.50659000 0.01635500 0.36647400 1.0 Ti Ti16 1 0.49341000 0.51635500 0.63352600 1.0 Ti Ti17 1 0.24061800 0.26741900 0.74838000 1.0 Ti Ti18 1 0.74061800 0.76741900 0.75162000 1.0 Ti Ti19 1 0.99341000 0.01635500 0.86647400 1.0 As As20 1 0.83378200 0.77223100 0.00196600 1.0 As As21 1 0.51522900 0.51421400 0.18135300 1.0 As As22 1 0.01522900 0.01421400 0.31864700 1.0 As As23 1 0.33378200 0.27223100 0.49803400 1.0 As As24 1 0.66621800 0.77223100 0.50196600 1.0 As As25 1 0.98477100 0.51421400 0.68135300 1.0 As As26 1 0.48477100 0.01421400 0.81864700 1.0 As As27 1 0.16621800 0.27223100 0.99803400 1.0 O O28 1 0.03142800 0.40554400 0.99717700 1.0 O O29 1 0.99760200 0.65207600 0.00341500 1.0 O O30 1 0.32574700 0.25432300 0.09905800 1.0 O O31 1 0.71153700 0.48763500 0.10153400 1.0 O O32 1 0.67559500 0.77840100 0.10420900 1.0 O O33 1 0.31129100 0.54985800 0.10812100 1.0 O O34 1 0.06095500 0.39394900 0.22085700 1.0 O O35 1 0.95961300 0.64419400 0.21859600 1.0 O O36 1 0.05178600 0.12999200 0.22994100 1.0 O O37 1 0.97609500 0.89793100 0.23261200 1.0 O O38 1 0.47609500 0.39793100 0.26738800 1.0 O O39 1 0.55178600 0.62999200 0.27005900 1.0 O O40 1 0.45961300 0.14419400 0.28140400 1.0 O O41 1 0.56095500 0.89394900 0.27914300 1.0 O O42 1 0.81129100 0.04985800 0.39187900 1.0 O O43 1 0.17559500 0.27840100 0.39579100 1.0 O O44 1 0.21153700 0.98763500 0.39846600 1.0 O O45 1 0.82574700 0.75432300 0.40094200 1.0 O O46 1 0.49760200 0.15207600 0.49658500 1.0 O O47 1 0.53142800 0.90554400 0.50282300 1.0 O O48 1 0.46857200 0.40554400 0.49717700 1.0 O O49 1 0.50239800 0.65207600 0.50341500 1.0 O O50 1 0.17425300 0.25432300 0.59905800 1.0 O O51 1 0.78846300 0.48763500 0.60153400 1.0 O O52 1 0.82440500 0.77840100 0.60420900 1.0 O O53 1 0.18870900 0.54985800 0.60812100 1.0 O O54 1 0.43904500 0.39394900 0.72085700 1.0 O O55 1 0.54038700 0.64419400 0.71859600 1.0 O O56 1 0.44821400 0.12999200 0.72994100 1.0 O O57 1 0.52390500 0.89793100 0.73261200 1.0 O O58 1 0.02390500 0.39793100 0.76738800 1.0 O O59 1 0.94821400 0.62999200 0.77005900 1.0 O O60 1 0.04038700 0.14419400 0.78140400 1.0 O O61 1 0.93904500 0.89394900 0.77914300 1.0 O O62 1 0.68870900 0.04985800 0.89187900 1.0 O O63 1 0.32440500 0.27840100 0.89579100 1.0 O O64 1 0.28846300 0.98763500 0.89846600 1.0 O O65 1 0.67425300 0.75432300 0.90094200 1.0 O O66 1 0.00239800 0.15207600 0.99658500 1.0 O O67 1 0.96857200 0.90554400 0.00282300 1.0