# generated using pymatgen data_Mg14ZrSi _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.28997877 _cell_length_b 6.28997828 _cell_length_c 10.25954181 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000265 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg14ZrSi _chemical_formula_sum 'Mg14 Zr1 Si1' _cell_volume 351.52556166 _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 Mg Mg0 1 0.17374859 0.83687379 0.12500000 1.0 Mg Mg1 1 0.16387597 0.83193749 0.62500000 1.0 Mg Mg2 1 0.66312621 0.32625141 0.12500000 1.0 Mg Mg3 1 0.66806251 0.33612403 0.62500000 1.0 Mg Mg4 1 0.66312621 0.83687379 0.12500000 1.0 Mg Mg5 1 0.66806251 0.83193749 0.62500000 1.0 Mg Mg6 1 0.32678238 0.17321762 0.37785943 1.0 Mg Mg7 1 0.32678238 0.17321762 0.87214057 1.0 Mg Mg8 1 0.32678238 0.65356577 0.37785943 1.0 Mg Mg9 1 0.32678238 0.65356577 0.87214057 1.0 Mg Mg10 1 0.84643423 0.17321762 0.37785943 1.0 Mg Mg11 1 0.84643423 0.17321762 0.87214057 1.0 Mg Mg12 1 0.83333300 0.66666700 0.36656756 1.0 Mg Mg13 1 0.83333300 0.66666700 0.88343244 1.0 Zr Zr14 1 0.16666700 0.33333300 0.12500000 1.0 Si Si15 1 0.16666700 0.33333300 0.62500000 1.0