# generated using pymatgen data_HfMg6Zr _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.05609300 _cell_length_b 6.38546600 _cell_length_c 11.21669100 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural HfMg6Zr _chemical_formula_sum 'Hf2 Mg12 Zr2' _cell_volume 362.13658882 _cell_formula_units_Z 2 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 0.50000000 0.50000000 0.17501500 1.0 Hf Hf1 1 0.50000000 0.00000000 0.67501500 1.0 Mg Mg2 1 0.00000000 0.74467900 0.08216900 1.0 Mg Mg3 1 0.00000000 0.25532100 0.08216900 1.0 Mg Mg4 1 0.00000000 0.00000000 0.33532200 1.0 Mg Mg5 1 0.50000000 0.25492400 0.41816500 1.0 Mg Mg6 1 0.50000000 0.74507600 0.41816500 1.0 Mg Mg7 1 0.50000000 0.00000000 0.16465000 1.0 Mg Mg8 1 0.00000000 0.24467900 0.58216900 1.0 Mg Mg9 1 0.00000000 0.75532100 0.58216900 1.0 Mg Mg10 1 0.00000000 0.50000000 0.83532200 1.0 Mg Mg11 1 0.50000000 0.75492400 0.91816500 1.0 Mg Mg12 1 0.50000000 0.24507600 0.91816500 1.0 Mg Mg13 1 0.50000000 0.50000000 0.66465000 1.0 Zr Zr14 1 0.00000000 0.50000000 0.32434600 1.0 Zr Zr15 1 0.00000000 0.00000000 0.82434600 1.0