# generated using pymatgen data_KNa3V2(MoO5)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 11.33167546 _cell_length_b 11.66295997 _cell_length_c 16.77112100 _cell_angle_alpha 110.53933685 _cell_angle_beta 109.13437591 _cell_angle_gamma 89.98049665 _symmetry_Int_Tables_number 1 _chemical_formula_structural KNa3V2(MoO5)2 _chemical_formula_sum 'K8 Na24 V16 Mo16 O80' _cell_volume 1944.37672737 _cell_formula_units_Z 8 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 0.30682700 0.07065800 0.11761100 1.0 K K1 1 0.30700200 0.57082800 0.11732200 1.0 K K2 1 0.80589700 0.07152200 0.11734300 1.0 K K3 1 0.80573600 0.57083300 0.11696500 1.0 K K4 1 0.18543000 0.92520500 0.87725500 1.0 K K5 1 0.05531100 0.79648600 0.11761100 1.0 K K6 1 0.55746300 0.29677000 0.11654800 1.0 K K7 1 0.55725500 0.79599300 0.11700300 1.0 Na Na8 1 0.30510500 0.07094000 0.60885200 1.0 Na Na9 1 0.30575000 0.57057600 0.60891800 1.0 Na Na10 1 0.80566300 0.07101700 0.60902800 1.0 Na Na11 1 0.80528000 0.57103900 0.60917500 1.0 Na Na12 1 0.19862800 0.43250000 0.39453600 1.0 Na Na13 1 0.19623200 0.42778800 0.88865800 1.0 Na Na14 1 0.19963100 0.93197100 0.39547600 1.0 Na Na15 1 0.70057400 0.43379500 0.39669100 1.0 Na Na16 1 0.69587600 0.42781800 0.88818900 1.0 Na Na17 1 0.70001300 0.93335900 0.39685200 1.0 Na Na18 1 0.69682700 0.92854600 0.88847400 1.0 Na Na19 1 0.05508600 0.29064100 0.10641000 1.0 Na Na20 1 0.05476300 0.28826100 0.60757000 1.0 Na Na21 1 0.05453400 0.78692500 0.60625400 1.0 Na Na22 1 0.55564900 0.28819700 0.60906500 1.0 Na Na23 1 0.55519200 0.78783400 0.60886100 1.0 Na Na24 1 0.44996200 0.21383900 0.39701500 1.0 Na Na25 1 0.44678500 0.20964800 0.88887800 1.0 Na Na26 1 0.45072600 0.71336100 0.39671700 1.0 Na Na27 1 0.44562800 0.71007200 0.88872100 1.0 Na Na28 1 0.95001800 0.21328600 0.39683300 1.0 Na Na29 1 0.94756800 0.21023300 0.88955900 1.0 Na Na30 1 0.94969800 0.71357900 0.39687200 1.0 Na Na31 1 0.94601000 0.71020700 0.88924800 1.0 V V32 1 0.11129300 0.09485300 0.25711100 1.0 V V33 1 0.10017300 0.08690400 0.74393900 1.0 V V34 1 0.10910800 0.58583500 0.25458300 1.0 V V35 1 0.09991800 0.57881100 0.74604900 1.0 V V36 1 0.61201100 0.09095500 0.25748200 1.0 V V37 1 0.60356900 0.08687100 0.74765700 1.0 V V38 1 0.61009400 0.58908500 0.25745500 1.0 V V39 1 0.60088400 0.58411500 0.74692900 1.0 V V40 1 0.35597900 0.41480000 0.25545000 1.0 V V41 1 0.35122500 0.41191600 0.74687700 1.0 V V42 1 0.36106900 0.91736000 0.25762000 1.0 V V43 1 0.35478800 0.91308100 0.74384100 1.0 V V44 1 0.86337900 0.41647600 0.25748300 1.0 V V45 1 0.85080500 0.41167900 0.74783100 1.0 V V46 1 0.86167600 0.91680300 0.25706200 1.0 V V47 1 0.84976800 0.91319300 0.74774600 1.0 Mo Mo48 1 0.99978700 0.99859700 0.99658800 1.0 Mo Mo49 1 0.00689100 0.00022400 0.50022800 1.0 Mo Mo50 1 0.00003000 0.49602400 0.99435300 1.0 Mo Mo51 1 0.00763000 0.49998100 0.50135200 1.0 Mo Mo52 1 0.49926800 0.99605700 0.99322400 1.0 Mo Mo53 1 0.50730400 0.00024900 0.50117000 1.0 Mo Mo54 1 0.49968200 0.49580000 0.99296700 1.0 Mo Mo55 1 0.50623100 0.49942700 0.50039000 1.0 Mo Mo56 1 0.25062800 0.24852400 0.99520600 1.0 Mo Mo57 1 0.25742300 0.25113000 0.50113300 1.0 Mo Mo58 1 0.24990100 0.74642200 0.99475400 1.0 Mo Mo59 1 0.25749700 0.74985700 0.49951500 1.0 Mo Mo60 1 0.75146700 0.24786900 0.99455000 1.0 Mo Mo61 1 0.75700000 0.25107500 0.50084200 1.0 Mo Mo62 1 0.74911900 0.74664200 0.99258400 1.0 Mo Mo63 1 0.75704700 0.75107400 0.50113500 1.0 O O64 1 0.12413000 0.11689300 0.48323700 1.0 O O65 1 0.11815200 0.12207300 0.98698200 1.0 O O66 1 0.12461900 0.61714900 0.48444500 1.0 O O67 1 0.11828600 0.61346700 0.97976300 1.0 O O68 1 0.62431400 0.11699000 0.48411600 1.0 O O69 1 0.61782600 0.11337800 0.97749500 1.0 O O70 1 0.62423300 0.61688400 0.48408300 1.0 O O71 1 0.61723000 0.61393600 0.97771100 1.0 O O72 1 0.13064000 0.37756600 0.00719500 1.0 O O73 1 0.14120600 0.38430200 0.51935100 1.0 O O74 1 0.12877300 0.87632500 0.00737300 1.0 O O75 1 0.14061200 0.88356200 0.51691700 1.0 O O76 1 0.62992900 0.37596100 0.00272700 1.0 O O77 1 0.64023600 0.38364000 0.51795800 1.0 O O78 1 0.62807400 0.87527800 0.00157900 1.0 O O79 1 0.64094100 0.88408800 0.51898000 1.0 O O80 1 0.37432500 0.11705700 0.48397900 1.0 O O81 1 0.37007400 0.11704000 0.98147100 1.0 O O82 1 0.37341200 0.61549900 0.48207000 1.0 O O83 1 0.36841200 0.61376900 0.97957800 1.0 O O84 1 0.87352500 0.11664700 0.48302200 1.0 O O85 1 0.86957100 0.11683100 0.98107500 1.0 O O86 1 0.87468700 0.61736900 0.48459200 1.0 O O87 1 0.86699900 0.61307200 0.97795400 1.0 O O88 1 0.37885600 0.37697500 0.00231900 1.0 O O89 1 0.39126000 0.38513600 0.51944300 1.0 O O90 1 0.38077900 0.87609400 0.00497300 1.0 O O91 1 0.39050700 0.88435700 0.51779500 1.0 O O92 1 0.88443900 0.37721800 0.00824900 1.0 O O93 1 0.89118300 0.38511100 0.51940400 1.0 O O94 1 0.87919800 0.87847500 0.00488300 1.0 O O95 1 0.89103800 0.88516100 0.51889500 1.0 O O96 1 0.07250100 0.09720700 0.14519200 1.0 O O97 1 0.07771700 0.11122700 0.64169600 1.0 O O98 1 0.07257400 0.58706000 0.14331300 1.0 O O99 1 0.08122400 0.60538000 0.64431300 1.0 O O100 1 0.57450200 0.08411400 0.14359700 1.0 O O101 1 0.58256000 0.10616800 0.64345200 1.0 O O102 1 0.57251300 0.58283100 0.14361400 1.0 O O103 1 0.58087200 0.60444800 0.64312000 1.0 O O104 1 0.43778900 0.38844500 0.35677000 1.0 O O105 1 0.43514600 0.39336400 0.85041700 1.0 O O106 1 0.44285800 0.88860300 0.35749200 1.0 O O107 1 0.42997100 0.89630900 0.84943400 1.0 O O108 1 0.94501500 0.38860900 0.35798600 1.0 O O109 1 0.93486100 0.39286200 0.85135700 1.0 O O110 1 0.94436100 0.88766300 0.35655600 1.0 O O111 1 0.93116100 0.89661200 0.85267800 1.0 O O112 1 0.32679100 0.30820100 0.14284400 1.0 O O113 1 0.33246700 0.28769800 0.64322200 1.0 O O114 1 0.32402400 0.80904700 0.14430400 1.0 O O115 1 0.33689900 0.78660400 0.64166200 1.0 O O116 1 0.82703700 0.30934500 0.14358200 1.0 O O117 1 0.83048700 0.28813100 0.64340200 1.0 O O118 1 0.82213300 0.80967500 0.14280100 1.0 O O119 1 0.83106900 0.78860700 0.64409900 1.0 O O120 1 0.19478000 0.22048000 0.35855800 1.0 O O121 1 0.18257300 0.20381800 0.85156000 1.0 O O122 1 0.19579400 0.71282000 0.35570300 1.0 O O123 1 0.18617000 0.69491600 0.85174500 1.0 O O124 1 0.69433600 0.21980400 0.35768000 1.0 O O125 1 0.68897800 0.20787000 0.85173100 1.0 O O126 1 0.69271500 0.71842700 0.35767800 1.0 O O127 1 0.68550700 0.70679800 0.85032400 1.0 O O128 1 0.45712400 0.05523000 0.26759600 1.0 O O129 1 0.43955700 0.05409900 0.74709300 1.0 O O130 1 0.45390100 0.55373100 0.26695900 1.0 O O131 1 0.43667800 0.55142200 0.74766000 1.0 O O132 1 0.95696800 0.05496900 0.26669700 1.0 O O133 1 0.93862400 0.04973600 0.74745900 1.0 O O134 1 0.95443300 0.55745000 0.26730600 1.0 O O135 1 0.93571400 0.55034000 0.74749200 1.0 O O136 1 0.19257400 0.44697500 0.25578500 1.0 O O137 1 0.18558300 0.44052200 0.74583000 1.0 O O138 1 0.20574200 0.96486000 0.26576900 1.0 O O139 1 0.18886400 0.94939900 0.73346500 1.0 O O140 1 0.70730000 0.46128900 0.26703900 1.0 O O141 1 0.68652900 0.44564300 0.74778700 1.0 O O142 1 0.70696200 0.96215800 0.26752900 1.0 O O143 1 0.68583500 0.94632100 0.74742200 1.0