# generated using pymatgen data_Li2Ni3TeO8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.90839734 _cell_length_b 10.49391086 _cell_length_c 5.90707739 _cell_angle_alpha 106.32512417 _cell_angle_beta 59.85309260 _cell_angle_gamma 90.06813571 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li2Ni3TeO8 _chemical_formula_sum 'Li4 Ni6 Te2 O16' _cell_volume 299.58864657 _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 0.93248100 0.20191200 0.13334100 1.0 Li Li1 1 0.43120000 0.70201700 0.13467500 1.0 Li Li2 1 0.56874800 0.29811100 0.86536600 1.0 Li Li3 1 0.06749500 0.79813700 0.86663400 1.0 Ni Ni4 1 0.49991300 0.00001900 0.50003900 1.0 Ni Ni5 1 0.00000100 0.50004900 0.00019000 1.0 Ni Ni6 1 0.50021500 0.99993800 0.99978400 1.0 Ni Ni7 1 0.49992000 0.50000200 0.50015300 1.0 Ni Ni8 1 0.00003100 0.00007100 0.49997600 1.0 Ni Ni9 1 0.99993900 0.49989900 0.50007400 1.0 Te Te10 1 0.75163500 0.75001400 0.49822000 1.0 Te Te11 1 0.24841000 0.24998600 0.50166200 1.0 O O12 1 0.87407500 0.40558600 0.25682500 1.0 O O13 1 0.35106800 0.90564500 0.28033100 1.0 O O14 1 0.64903600 0.09439200 0.71955000 1.0 O O15 1 0.12582700 0.59436200 0.74343100 1.0 O O16 1 0.63972200 0.63013600 0.72266900 1.0 O O17 1 0.13448300 0.12792900 0.72350600 1.0 O O18 1 0.64261800 0.62969600 0.26259000 1.0 O O19 1 0.13286000 0.12975800 0.27254700 1.0 O O20 1 0.09532900 0.62781700 0.26232900 1.0 O O21 1 0.59238900 0.13004900 0.27004300 1.0 O O22 1 0.40764300 0.86994200 0.72981900 1.0 O O23 1 0.90471900 0.37215500 0.73768000 1.0 O O24 1 0.86712400 0.87022500 0.72736400 1.0 O O25 1 0.35734600 0.37020400 0.73736300 1.0 O O26 1 0.86548100 0.87208100 0.27649200 1.0 O O27 1 0.36029000 0.36986500 0.27734600 1.0