# generated using pymatgen data_LiVF4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.55590800 _cell_length_b 7.69373300 _cell_length_c 10.60456400 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiVF4 _chemical_formula_sum 'Li8 V8 F32' _cell_volume 616.47659013 _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 Li Li0 1 0.50000000 0.26530400 0.26623300 1.0 Li Li1 1 0.50000000 0.04682500 0.75678600 1.0 Li Li2 1 0.50000000 0.85097500 0.25756200 1.0 Li Li3 1 0.50000000 0.58948700 0.76203300 1.0 Li Li4 1 0.00000000 0.08948700 0.23796700 1.0 Li Li5 1 0.00000000 0.35097500 0.74243800 1.0 Li Li6 1 0.00000000 0.54682500 0.24321400 1.0 Li Li7 1 0.00000000 0.76530400 0.73376700 1.0 V V8 1 0.74766600 0.49225900 0.50418800 1.0 V V9 1 0.75036400 0.73801900 0.00410500 1.0 V V10 1 0.74963600 0.23801900 0.99589500 1.0 V V11 1 0.75233400 0.99225900 0.49581200 1.0 V V12 1 0.24766600 0.99225900 0.49581200 1.0 V V13 1 0.25036400 0.23801900 0.99589500 1.0 V V14 1 0.24963600 0.73801900 0.00410500 1.0 V V15 1 0.25233400 0.49225900 0.50418800 1.0 F F16 1 0.50000000 0.20288400 0.07096300 1.0 F F17 1 0.50000000 0.02946400 0.56845300 1.0 F F18 1 0.50000000 0.78584700 0.07722000 1.0 F F19 1 0.50000000 0.47302800 0.58473000 1.0 F F20 1 0.66773500 0.75764600 0.83503400 1.0 F F21 1 0.67138100 0.43695700 0.33987200 1.0 F F22 1 0.67151400 0.02161900 0.32480000 1.0 F F23 1 0.67969300 0.20075800 0.82562000 1.0 F F24 1 0.69382900 0.48678100 0.98677300 1.0 F F25 1 0.69534600 0.74024400 0.47593900 1.0 F F26 1 0.80465400 0.24024400 0.52406100 1.0 F F27 1 0.80617100 0.98678100 0.01322700 1.0 F F28 1 0.82030700 0.70075800 0.17438000 1.0 F F29 1 0.82848600 0.52161900 0.67520000 1.0 F F30 1 0.82861900 0.93695700 0.66012800 1.0 F F31 1 0.83226500 0.25764600 0.16496600 1.0 F F32 1 0.00000000 0.28584700 0.92278000 1.0 F F33 1 0.00000000 0.52946400 0.43154700 1.0 F F34 1 0.00000000 0.97302800 0.41527000 1.0 F F35 1 0.00000000 0.70288400 0.92903700 1.0 F F36 1 0.16773500 0.25764600 0.16496600 1.0 F F37 1 0.17138100 0.93695700 0.66012800 1.0 F F38 1 0.17151400 0.52161900 0.67520000 1.0 F F39 1 0.17969300 0.70075800 0.17438000 1.0 F F40 1 0.19382900 0.98678100 0.01322700 1.0 F F41 1 0.19534600 0.24024400 0.52406100 1.0 F F42 1 0.30465400 0.74024400 0.47593900 1.0 F F43 1 0.30617100 0.48678100 0.98677300 1.0 F F44 1 0.32030700 0.20075800 0.82562000 1.0 F F45 1 0.32848600 0.02161900 0.32480000 1.0 F F46 1 0.32861900 0.43695700 0.33987200 1.0 F F47 1 0.33226500 0.75764600 0.83503400 1.0