# generated using pymatgen data_HfScInCu2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.16061561 _cell_length_b 7.16061561 _cell_length_c 6.80037881 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural HfScInCu2 _chemical_formula_sum 'Hf4 Sc4 In4 Cu8' _cell_volume 348.68545126 _cell_formula_units_Z 4 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 0.14998184 0.14998184 0.00000000 1.0 Hf Hf1 1 0.85001816 0.85001816 0.00000000 1.0 Hf Hf2 1 0.64998184 0.35001816 0.50000000 1.0 Hf Hf3 1 0.35001816 0.64998184 0.50000000 1.0 Sc Sc4 1 0.68744994 0.31255006 0.00000000 1.0 Sc Sc5 1 0.31255006 0.68744994 0.00000000 1.0 Sc Sc6 1 0.81255006 0.81255006 0.50000000 1.0 Sc Sc7 1 0.18744994 0.18744994 0.50000000 1.0 In In8 1 0.50000000 0.00000000 0.25000000 1.0 In In9 1 0.50000000 0.00000000 0.75000000 1.0 In In10 1 0.00000000 0.50000000 0.25000000 1.0 In In11 1 0.00000000 0.50000000 0.75000000 1.0 Cu Cu12 1 0.37600627 0.37600627 0.20952031 1.0 Cu Cu13 1 0.62399373 0.62399373 0.79047969 1.0 Cu Cu14 1 0.62399373 0.62399373 0.20952031 1.0 Cu Cu15 1 0.87600627 0.12399373 0.70952031 1.0 Cu Cu16 1 0.87600627 0.12399373 0.29047969 1.0 Cu Cu17 1 0.37600627 0.37600627 0.79047969 1.0 Cu Cu18 1 0.12399373 0.87600627 0.29047969 1.0 Cu Cu19 1 0.12399373 0.87600627 0.70952031 1.0