# generated using pymatgen data_Ti10Pt6S _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.92394421 _cell_length_b 7.92394471 _cell_length_c 4.99094197 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000205 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti10Pt6S _chemical_formula_sum 'Ti10 Pt6 S1' _cell_volume 271.39134209 _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 0.66666700 0.33333300 0.50000000 1.0 Ti Ti1 1 0.33333300 0.66666700 0.50000000 1.0 Ti Ti2 1 0.33333300 0.66666700 0.00000000 1.0 Ti Ti3 1 0.66666700 0.33333300 0.00000000 1.0 Ti Ti4 1 0.74432498 0.74432498 0.24426711 1.0 Ti Ti5 1 0.25567502 0.00000000 0.24426711 1.0 Ti Ti6 1 0.00000000 0.25567502 0.24426711 1.0 Ti Ti7 1 0.25567502 0.25567502 0.75573289 1.0 Ti Ti8 1 0.74432498 1.00000000 0.75573289 1.0 Ti Ti9 1 0.00000000 0.74432498 0.75573289 1.0 Pt Pt10 1 0.40423479 0.40423479 0.25116265 1.0 Pt Pt11 1 0.59576521 0.00000000 0.25116265 1.0 Pt Pt12 1 0.00000000 0.59576521 0.25116265 1.0 Pt Pt13 1 0.59576521 0.59576521 0.74883735 1.0 Pt Pt14 1 0.40423479 1.00000000 0.74883735 1.0 Pt Pt15 1 0.00000000 0.40423479 0.74883735 1.0 S S16 1 0.00000000 0.00000000 0.50000000 1.0