# generated using pymatgen data_TiAl7Pt16 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 16.32116298 _cell_length_b 3.94143472 _cell_length_c 5.47551683 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural TiAl7Pt16 _chemical_formula_sum 'Ti1 Al7 Pt16' _cell_volume 352.23341851 _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 0.25000000 0.00000000 0.80058488 1.0 Al Al1 1 0.08968128 0.00000000 0.31056112 1.0 Al Al2 1 0.41031872 0.00000000 0.31056112 1.0 Al Al3 1 0.59197602 0.00000000 0.68636490 1.0 Al Al4 1 0.90802298 0.00000000 0.68636490 1.0 Al Al5 1 0.75000000 0.00000000 0.20209302 1.0 Al Al6 1 0.00053325 0.49999900 0.99714666 1.0 Al Al7 1 0.49946675 0.49999900 0.99714666 1.0 Pt Pt8 1 0.25000000 0.00000000 0.29063182 1.0 Pt Pt9 1 0.75000000 0.00000000 0.72426662 1.0 Pt Pt10 1 0.16789492 0.49999900 0.55828900 1.0 Pt Pt11 1 0.33210508 0.49999900 0.55828900 1.0 Pt Pt12 1 0.66751988 0.49999900 0.43928587 1.0 Pt Pt13 1 0.83248012 0.49999900 0.43928587 1.0 Pt Pt14 1 0.16013468 0.49999900 0.05304917 1.0 Pt Pt15 1 0.33986632 0.49999900 0.05304917 1.0 Pt Pt16 1 0.65553135 0.49999900 0.94405721 1.0 Pt Pt17 1 0.84446965 0.49999900 0.94405721 1.0 Pt Pt18 1 0.00044661 0.49999900 0.50055369 1.0 Pt Pt19 1 0.49955339 0.49999900 0.50055369 1.0 Pt Pt20 1 0.07192993 0.00000000 0.80164679 1.0 Pt Pt21 1 0.42807007 0.00000000 0.80164679 1.0 Pt Pt22 1 0.56815118 0.00000000 0.20025542 1.0 Pt Pt23 1 0.93184782 0.00000000 0.20025542 1.0