# generated using pymatgen data_Hf18Ti3Fe2Pt5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.56514196 _cell_length_b 8.50227385 _cell_length_c 8.52810396 _cell_angle_alpha 119.90337309 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf18Ti3Fe2Pt5 _chemical_formula_sum 'Hf18 Ti3 Fe2 Pt5' _cell_volume 538.36251288 _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 Hf Hf0 1 0.56513776 0.79699103 0.59397067 1.0 Hf Hf1 1 0.56111849 0.80112135 0.21045677 1.0 Hf Hf2 1 0.56117135 0.40936159 0.21051888 1.0 Hf Hf3 1 0.44602256 0.19943822 0.39891980 1.0 Hf Hf4 1 0.43930126 0.20593837 0.79351904 1.0 Hf Hf5 1 0.43927889 0.58747712 0.79346641 1.0 Hf Hf6 1 0.05397744 0.19943822 0.39891980 1.0 Hf Hf7 1 0.06069874 0.20593837 0.79351904 1.0 Hf Hf8 1 0.06072111 0.58747712 0.79346641 1.0 Hf Hf9 1 0.93486224 0.79699103 0.59397067 1.0 Hf Hf10 1 0.93888151 0.80112135 0.21045677 1.0 Hf Hf11 1 0.93882865 0.40936159 0.21051888 1.0 Hf Hf12 1 0.75000000 0.46339804 0.92668854 1.0 Hf Hf13 1 0.75000000 0.45259996 0.54002552 1.0 Hf Hf14 1 0.75000000 0.08738404 0.54000307 1.0 Hf Hf15 1 0.25000000 0.54047923 0.08104355 1.0 Hf Hf16 1 0.25000000 0.54090171 0.46114754 1.0 Hf Hf17 1 0.25000000 0.92029108 0.46112651 1.0 Ti Ti18 1 0.75000000 0.11354157 0.22701236 1.0 Ti Ti19 1 0.49367308 0.99721245 0.99444068 1.0 Ti Ti20 1 0.00632692 0.99721245 0.99444068 1.0 Fe Fe21 1 0.75000000 0.66591455 0.33157465 1.0 Fe Fe22 1 0.25000000 0.33466957 0.66961746 1.0 Pt Pt23 1 0.75000000 0.11758209 0.89028564 1.0 Pt Pt24 1 0.75000000 0.77277488 0.89016062 1.0 Pt Pt25 1 0.25000000 0.87910030 0.75816977 1.0 Pt Pt26 1 0.25000000 0.87764925 0.11624707 1.0 Pt Pt27 1 0.25000000 0.23863448 0.11630821 1.0