# generated using pymatgen data_Mg5Si6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 16.80035177 _cell_length_b 16.80035177 _cell_length_c 5.86562455 _cell_angle_alpha 80.46081326 _cell_angle_beta 80.46081326 _cell_angle_gamma 13.89880942 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg5Si6 _chemical_formula_sum 'Mg10 Si12' _cell_volume 392.10285680 _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 Mg Mg0 1 0.25393900 0.25393900 0.97656400 1.0 Mg Mg1 1 0.98537700 0.98537700 0.77616900 1.0 Mg Mg2 1 0.42981600 0.42981600 0.58270500 1.0 Mg Mg3 1 0.08214600 0.08214600 0.35966700 1.0 Mg Mg4 1 0.71061500 0.71061500 0.27933600 1.0 Mg Mg5 1 0.79686700 0.79686700 0.67193200 1.0 Mg Mg6 1 0.43429900 0.43429900 0.07617400 1.0 Mg Mg7 1 0.52387800 0.52387800 0.17466500 1.0 Mg Mg8 1 0.70105200 0.70105200 0.77505400 1.0 Mg Mg9 1 0.80694300 0.80694300 0.18003300 1.0 Si Si10 1 0.25191300 0.25191300 0.47946000 1.0 Si Si11 1 0.16387100 0.16387100 0.51886900 1.0 Si Si12 1 0.54202500 0.54202500 0.66474900 1.0 Si Si13 1 0.96790600 0.96790600 0.29843700 1.0 Si Si14 1 0.34391100 0.34391100 0.86099100 1.0 Si Si15 1 0.16349000 0.16349000 0.09718700 1.0 Si Si16 1 0.62050400 0.62050400 0.64394500 1.0 Si Si17 1 0.88902900 0.88902900 0.32370200 1.0 Si Si18 1 0.34739800 0.34739800 0.43403400 1.0 Si Si19 1 0.06663700 0.06663700 0.86809400 1.0 Si Si20 1 0.62078500 0.62078500 0.05440900 1.0 Si Si21 1 0.88809100 0.88809100 0.89651400 1.0