# generated using pymatgen data_Li5V3P8O29 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.76792300 _cell_length_b 9.76837594 _cell_length_c 14.06716327 _cell_angle_alpha 89.76126992 _cell_angle_beta 89.74727669 _cell_angle_gamma 60.20540377 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li5V3P8O29 _chemical_formula_sum 'Li10 V6 P16 O58' _cell_volume 1164.80059396 _cell_formula_units_Z 2 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 Li Li0 1 0.90281600 0.77010100 0.43816100 1.0 Li Li1 1 0.32243000 0.90546900 0.43449500 1.0 Li Li2 1 0.32843100 0.76658800 0.94284500 1.0 Li Li3 1 0.90596500 0.32869700 0.94507300 1.0 Li Li4 1 0.22646100 0.68068700 0.55916600 1.0 Li Li5 1 0.77111700 0.32345500 0.43780700 1.0 Li Li6 1 0.66952900 0.23145500 0.05931600 1.0 Li Li7 1 0.68339600 0.09152400 0.56306300 1.0 Li Li8 1 0.09046800 0.22316300 0.55492400 1.0 Li Li9 1 0.01047300 0.94387300 0.00976300 1.0 V V10 1 0.43360900 0.56928400 0.75055500 1.0 V V11 1 0.56548100 0.43295900 0.25082000 1.0 V V12 1 0.00169800 0.56761900 0.24178600 1.0 V V13 1 0.00089100 0.43672200 0.75502200 1.0 V V14 1 0.56813000 0.99753200 0.75579900 1.0 V V15 1 0.43202000 0.00373600 0.24624500 1.0 P P16 1 0.77860600 0.91914200 0.16065700 1.0 P P17 1 0.91343300 0.76952300 0.65781600 1.0 P P18 1 0.31928300 0.91533900 0.65493900 1.0 P P19 1 0.66835600 0.66362300 0.87052100 1.0 P P20 1 0.67064100 0.66549400 0.36884800 1.0 P P21 1 0.31478100 0.77246700 0.15863300 1.0 P P22 1 0.22798100 0.67972800 0.34019800 1.0 P P23 1 0.91267800 0.31312500 0.15695500 1.0 P P24 1 0.08376900 0.69609100 0.84256600 1.0 P P25 1 0.77121900 0.32287900 0.65810700 1.0 P P26 1 0.68442900 0.23019600 0.84017600 1.0 P P27 1 0.33257300 0.33312900 0.63240800 1.0 P P28 1 0.33414800 0.33335000 0.12916400 1.0 P P29 1 0.67989800 0.08640200 0.34547000 1.0 P P30 1 0.08694000 0.23281600 0.33955800 1.0 P P31 1 0.22089200 0.08267500 0.83969600 1.0 O O32 1 0.75365900 0.00022500 0.43664800 1.0 O O33 1 0.74884000 0.91833700 0.66016500 1.0 O O34 1 0.99694500 0.79343400 0.92518300 1.0 O O35 1 0.91772700 0.74560600 0.16399500 1.0 O O36 1 0.62007000 0.92411100 0.16516100 1.0 O O37 1 0.67791700 0.80475600 0.82772900 1.0 O O38 1 0.47810100 0.90615200 0.67672600 1.0 O O39 1 0.20396000 0.98997900 0.91845300 1.0 O O40 1 0.34674600 0.91150500 0.16993800 1.0 O O41 1 0.81661300 0.67048300 0.32194400 1.0 O O42 1 0.90258100 0.61928400 0.68049300 1.0 O O43 1 0.51705300 0.81316800 0.33253200 1.0 O O44 1 0.68004700 0.64280100 0.97528100 1.0 O O45 1 0.68653400 0.65905700 0.47470400 1.0 O O46 1 0.51121900 0.67614300 0.83167800 1.0 O O47 1 0.91041700 0.47275200 0.17139100 1.0 O O48 1 0.81399100 0.50638200 0.82542700 1.0 O O49 1 0.33718000 0.74811200 0.65882500 1.0 O O50 1 0.20460100 0.79071300 0.24975900 1.0 O O51 1 0.23907500 0.75827600 0.42975600 1.0 O O52 1 0.22743800 0.78774400 0.06887400 1.0 O O53 1 0.46961300 0.61618300 0.17050900 1.0 O O54 1 0.67401900 0.51178400 0.33041000 1.0 O O55 1 0.25686400 0.66084400 0.83925800 1.0 O O56 1 0.62389700 0.48251300 0.67692400 1.0 O O57 1 0.92283200 0.33707000 0.65910700 1.0 O O58 1 0.01026500 0.78957200 0.74328800 1.0 O O59 1 0.00012700 0.75160800 0.56606700 1.0 O O60 1 0.99588400 0.24579700 0.42907700 1.0 O O61 1 0.07831200 0.66329700 0.34025800 1.0 O O62 1 0.37657500 0.51904400 0.32305800 1.0 O O63 1 0.74294100 0.33929400 0.16267000 1.0 O O64 1 0.32798700 0.48709800 0.66809400 1.0 O O65 1 0.52655000 0.38470100 0.82585900 1.0 O O66 1 0.76786500 0.23125900 0.92908800 1.0 O O67 1 0.76130200 0.24403100 0.56868900 1.0 O O68 1 0.79327700 0.20948000 0.74829200 1.0 O O69 1 0.66163200 0.25321400 0.34351200 1.0 O O70 1 0.18727400 0.48758000 0.17583000 1.0 O O71 1 0.08065900 0.53747000 0.83021700 1.0 O O72 1 0.48927100 0.32361000 0.16881300 1.0 O O73 1 0.32716600 0.34405100 0.02406800 1.0 O O74 1 0.31531800 0.33121900 0.52740900 1.0 O O75 1 0.48401300 0.18649100 0.67138900 1.0 O O76 1 0.09472500 0.38369100 0.31989300 1.0 O O77 1 0.18410700 0.33192200 0.68185300 1.0 O O78 1 0.65634800 0.08817700 0.83587500 1.0 O O79 1 0.79853800 0.99176900 0.26010400 1.0 O O80 1 0.80367200 0.00739700 0.08154700 1.0 O O81 1 0.52115000 0.09586500 0.32465400 1.0 O O82 1 0.32293700 0.19455100 0.17443500 1.0 O O83 1 0.37641400 0.08428300 0.83123900 1.0 O O84 1 0.07827700 0.25663000 0.84024800 1.0 O O85 1 0.99118300 0.23120400 0.06712000 1.0 O O86 1 0.99848200 0.20847700 0.24967400 1.0 O O87 1 0.25182700 0.08407400 0.34090000 1.0 O O88 1 0.24770200 0.99673100 0.56260500 1.0 O O89 1 0.19859700 0.01374100 0.73886300 1.0