# generated using pymatgen data_LiHfMg6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.07039400 _cell_length_b 6.33036300 _cell_length_c 11.03255400 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiHfMg6 _chemical_formula_sum 'Li2 Hf2 Mg12' _cell_volume 354.11668019 _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 Li Li0 1 0.00000000 0.50000000 0.33222600 1.0 Li Li1 1 0.00000000 0.00000000 0.83222600 1.0 Hf Hf2 1 0.50000000 0.50000000 0.16554900 1.0 Hf Hf3 1 0.50000000 0.00000000 0.66554900 1.0 Mg Mg4 1 0.00000000 0.25457100 0.08479000 1.0 Mg Mg5 1 0.00000000 0.74542900 0.08479000 1.0 Mg Mg6 1 0.00000000 0.00000000 0.33322200 1.0 Mg Mg7 1 0.50000000 0.74562300 0.41738200 1.0 Mg Mg8 1 0.50000000 0.25437700 0.41738200 1.0 Mg Mg9 1 0.50000000 0.00000000 0.16465800 1.0 Mg Mg10 1 0.00000000 0.75457100 0.58479000 1.0 Mg Mg11 1 0.00000000 0.24542900 0.58479000 1.0 Mg Mg12 1 0.00000000 0.50000000 0.83322200 1.0 Mg Mg13 1 0.50000000 0.24562300 0.91738200 1.0 Mg Mg14 1 0.50000000 0.75437700 0.91738200 1.0 Mg Mg15 1 0.50000000 0.50000000 0.66465800 1.0