# generated using pymatgen data_LiNbVO4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.15302400 _cell_length_b 8.63228946 _cell_length_c 6.15311045 _cell_angle_alpha 90.45329301 _cell_angle_beta 89.18703132 _cell_angle_gamma 89.54755243 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiNbVO4 _chemical_formula_sum 'Li4 Nb4 V4 O16' _cell_volume 326.76690986 _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 Li Li0 1 0.00335000 0.12499100 0.25339400 1.0 Li Li1 1 0.50334300 0.62500400 0.75332400 1.0 Li Li2 1 0.99672200 0.87503700 0.74667000 1.0 Li Li3 1 0.49667200 0.37496500 0.24672200 1.0 Nb Nb4 1 0.25067700 0.25077000 0.75393800 1.0 Nb Nb5 1 0.75101400 0.75048900 0.25350300 1.0 Nb Nb6 1 0.00335300 0.49948000 0.00091400 1.0 Nb Nb7 1 0.50410000 0.99921200 0.50073800 1.0 V V8 1 0.49440500 0.99690600 0.00150200 1.0 V V9 1 0.25152000 0.75320400 0.24437500 1.0 V V10 1 0.99439800 0.49684100 0.50148600 1.0 V V11 1 0.75145500 0.25307500 0.74444100 1.0 O O12 1 0.01534700 0.25638200 0.52752000 1.0 O O13 1 0.51514100 0.75629300 0.02762000 1.0 O O14 1 0.77762800 0.49376400 0.76526600 1.0 O O15 1 0.27748400 0.99357100 0.26525700 1.0 O O16 1 0.22008000 0.50986600 0.24023000 1.0 O O17 1 0.72004100 0.00962400 0.74025400 1.0 O O18 1 0.99035100 0.74029000 0.46997000 1.0 O O19 1 0.49014900 0.24027600 0.97014600 1.0 O O20 1 0.23217000 0.49246800 0.74703600 1.0 O O21 1 0.73209500 0.99261000 0.24712200 1.0 O O22 1 0.99720500 0.25740700 0.98213100 1.0 O O23 1 0.49696200 0.75749000 0.48210900 1.0 O O24 1 0.76673200 0.50780500 0.25054600 1.0 O O25 1 0.26689000 0.00811300 0.75014800 1.0 O O26 1 0.00059900 0.74219300 0.01672200 1.0 O O27 1 0.50011700 0.24187000 0.51692100 1.0