# generated using pymatgen data_TiNb5Pt2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.17759120 _cell_length_b 5.17759120 _cell_length_c 5.14763023 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural TiNb5Pt2 _chemical_formula_sum 'Ti1 Nb5 Pt2' _cell_volume 137.99484327 _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 Ti Ti0 1 0.50000000 0.00000000 0.75000000 1.0 Nb Nb1 1 0.00000000 0.24961055 0.49842377 1.0 Nb Nb2 1 0.00000000 0.75038945 0.49842377 1.0 Nb Nb3 1 0.25038945 0.50000000 0.00157623 1.0 Nb Nb4 1 0.74961055 0.50000000 0.00157623 1.0 Nb Nb5 1 0.50000000 0.00000000 0.25000000 1.0 Pt Pt6 1 0.50000000 0.50000000 0.50939429 1.0 Pt Pt7 1 0.00000000 0.00000000 0.99060571 1.0