# generated using pymatgen data_Li2TiVO4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.18157970 _cell_length_b 6.02492025 _cell_length_c 7.92220001 _cell_angle_alpha 78.14478969 _cell_angle_beta 102.62566509 _cell_angle_gamma 106.68134981 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li2TiVO4 _chemical_formula_sum 'Li6 Ti3 V3 O12' _cell_volume 228.47340937 _cell_formula_units_Z 3 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 0.49975400 0.83164300 0.16829000 1.0 Li Li1 1 0.99339300 0.67022000 0.33476300 1.0 Li Li2 1 0.49998800 0.49995700 0.49999000 1.0 Li Li3 1 0.00667300 0.32982100 0.66523100 1.0 Li Li4 1 0.50027000 0.16840300 0.83171300 1.0 Li Li5 1 0.99993100 0.99996500 0.99999400 1.0 Ti Ti6 1 0.49991300 0.67183500 0.82871500 1.0 Ti Ti7 1 0.50010500 0.32831900 0.17116300 1.0 Ti Ti8 1 0.50002200 0.99975200 0.50024500 1.0 V V9 1 0.00029200 0.82925500 0.67037100 1.0 V V10 1 0.99970400 0.17080600 0.32957100 1.0 V V11 1 0.99997500 0.49997700 0.00003000 1.0 O O12 1 0.25904000 0.81341600 0.91647300 1.0 O O13 1 0.73562400 0.98816200 0.74785500 1.0 O O14 1 0.73936600 0.84791200 0.42381700 1.0 O O15 1 0.26482400 0.67271800 0.59003100 1.0 O O16 1 0.26483500 0.34791800 0.92405200 1.0 O O17 1 0.74061600 0.50740900 0.76348500 1.0 O O18 1 0.25929300 0.49262500 0.23645500 1.0 O O19 1 0.73518500 0.65189900 0.07610100 1.0 O O20 1 0.73464700 0.32702500 0.40969500 1.0 O O21 1 0.26064200 0.15203300 0.57627200 1.0 O O22 1 0.26488400 0.01228900 0.25220600 1.0 O O23 1 0.74106100 0.18663700 0.08347900 1.0