# generated using pymatgen data_Ta2TlO6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.54396625 _cell_length_b 7.54396625 _cell_length_c 7.54396625 _cell_angle_alpha 120.08047560 _cell_angle_beta 119.96611260 _cell_angle_gamma 89.95968672 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ta2TlO6 _chemical_formula_sum 'Ta4 Tl2 O12' _cell_volume 303.48037875 _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 Ta Ta0 1 0.00000000 0.00000000 0.50000000 1.0 Ta Ta1 1 0.50000000 0.00000000 0.50000000 1.0 Ta Ta2 1 0.00000000 0.00000000 0.00000000 1.0 Ta Ta3 1 0.00000000 0.50000000 0.00000000 1.0 Tl Tl4 1 0.50000000 0.50000000 0.50000000 1.0 Tl Tl5 1 0.50000000 0.00000000 0.00000000 1.0 O O6 1 0.05726700 0.30726700 0.75000000 1.0 O O7 1 0.68743000 0.94187700 0.37596500 1.0 O O8 1 0.06591100 0.94187700 0.75444700 1.0 O O9 1 0.68743000 0.31146500 0.74555300 1.0 O O10 1 0.31380300 0.06380300 0.25000000 1.0 O O11 1 0.93408900 0.68853500 0.87596500 1.0 O O12 1 0.06591100 0.31146500 0.12403500 1.0 O O13 1 0.68619700 0.93619700 0.75000000 1.0 O O14 1 0.31257000 0.68853500 0.25444700 1.0 O O15 1 0.93408900 0.05812300 0.24555300 1.0 O O16 1 0.94273300 0.69273300 0.25000000 1.0 O O17 1 0.31257000 0.05812300 0.62403500 1.0