# generated using pymatgen data_ScAl7Pt16 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.95115629 _cell_length_b 5.49321041 _cell_length_c 16.36741966 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural ScAl7Pt16 _chemical_formula_sum 'Sc1 Al7 Pt16' _cell_volume 355.24719834 _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 Sc Sc0 1 0.00000000 0.19524051 0.75000000 1.0 Al Al1 1 0.00000000 0.79836344 0.25000000 1.0 Al Al2 1 0.00000000 0.68790598 0.59037475 1.0 Al Al3 1 0.00000000 0.31511754 0.40775796 1.0 Al Al4 1 0.00000000 0.68790598 0.90962525 1.0 Al Al5 1 0.00000000 0.31511754 0.09224204 1.0 Al Al6 1 0.50000000 0.00276441 0.49877767 1.0 Al Al7 1 0.50000000 0.00276441 0.00122233 1.0 Pt Pt8 1 0.50000000 0.05538133 0.34307603 1.0 Pt Pt9 1 0.50000000 0.94176632 0.65524159 1.0 Pt Pt10 1 0.50000000 0.55922525 0.16783655 1.0 Pt Pt11 1 0.50000000 0.44317073 0.83456108 1.0 Pt Pt12 1 0.50000000 0.55922525 0.33216345 1.0 Pt Pt13 1 0.50000000 0.44317073 0.66543892 1.0 Pt Pt14 1 0.00000000 0.27686568 0.25000000 1.0 Pt Pt15 1 0.00000000 0.70623108 0.75000000 1.0 Pt Pt16 1 0.50000000 0.94176632 0.84475841 1.0 Pt Pt17 1 0.50000000 0.05538133 0.15692397 1.0 Pt Pt18 1 0.50000000 0.50380593 0.49911634 1.0 Pt Pt19 1 0.50000000 0.50380593 0.00088366 1.0 Pt Pt20 1 0.00000000 0.20071636 0.56743609 1.0 Pt Pt21 1 0.00000000 0.80179480 0.43017268 1.0 Pt Pt22 1 0.00000000 0.20071636 0.93256391 1.0 Pt Pt23 1 0.00000000 0.80179480 0.06982732 1.0