# generated using pymatgen data_Nb8Tl8O25 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.64763076 _cell_length_b 7.64763076 _cell_length_c 13.23375956 _cell_angle_alpha 73.21387555 _cell_angle_beta 73.21387555 _cell_angle_gamma 60.02092985 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb8Tl8O25 _chemical_formula_sum 'Nb8 Tl8 O25' _cell_volume 632.05340929 _cell_formula_units_Z 1 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 Nb Nb0 1 0.00007600 0.50059700 0.99986400 1.0 Nb Nb1 1 0.00063000 0.50016700 0.49990400 1.0 Nb Nb2 1 0.50059700 0.00007600 0.99986400 1.0 Nb Nb3 1 0.50034000 0.50034000 0.49981700 1.0 Nb Nb4 1 0.00036000 0.00036000 0.99969500 1.0 Nb Nb5 1 0.75014400 0.75014400 0.25011000 1.0 Nb Nb6 1 0.50016700 0.00063000 0.49990400 1.0 Nb Nb7 1 0.25042300 0.25042300 0.74908800 1.0 Tl Tl8 1 0.26091600 0.72869500 0.24485100 1.0 Tl Tl9 1 0.24306200 0.75378400 0.74931200 1.0 Tl Tl10 1 0.75374000 0.75374000 0.74951800 1.0 Tl Tl11 1 0.49844700 0.49844700 0.00269200 1.0 Tl Tl12 1 0.23462500 0.23462500 0.25452000 1.0 Tl Tl13 1 0.99534100 0.99534100 0.51283500 1.0 Tl Tl14 1 0.72869500 0.26091600 0.24485100 1.0 Tl Tl15 1 0.75378400 0.24306200 0.74931200 1.0 O O16 1 0.90443400 0.53395700 0.15517300 1.0 O O17 1 0.90615500 0.90615500 0.15581800 1.0 O O18 1 0.28051700 0.90907500 0.02992500 1.0 O O19 1 0.96687600 0.59333400 0.34441500 1.0 O O20 1 0.77980300 0.77980300 0.53132100 1.0 O O21 1 0.28070400 0.28070400 0.03093400 1.0 O O22 1 0.09290400 0.71922700 0.96883100 1.0 O O23 1 0.53395700 0.90443400 0.15517300 1.0 O O24 1 0.21963800 0.59127300 0.46944900 1.0 O O25 1 0.56228600 0.56228600 0.81307700 1.0 O O26 1 0.40572700 0.03220700 0.65640200 1.0 O O27 1 0.59127300 0.21963800 0.46944900 1.0 O O28 1 0.59500400 0.59500400 0.34505100 1.0 O O29 1 0.40566000 0.40566000 0.65639000 1.0 O O30 1 0.46701800 0.09441300 0.84438000 1.0 O O31 1 0.90907500 0.28051700 0.02992500 1.0 O O32 1 0.59333400 0.96687600 0.34441500 1.0 O O33 1 0.77978400 0.40904400 0.53145200 1.0 O O34 1 0.40904400 0.77978400 0.53145200 1.0 O O35 1 0.71907700 0.71907700 0.96880500 1.0 O O36 1 0.21968400 0.21968400 0.47031400 1.0 O O37 1 0.03220700 0.40572700 0.65640200 1.0 O O38 1 0.71922700 0.09290400 0.96883100 1.0 O O39 1 0.09419300 0.09419300 0.84431900 1.0 O O40 1 0.09441300 0.46701800 0.84438000 1.0