# generated using pymatgen data_Mg5Si6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.24789500 _cell_length_b 6.35520845 _cell_length_c 13.37212178 _cell_angle_alpha 86.82834476 _cell_angle_beta 82.27305636 _cell_angle_gamma 78.94225206 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg5Si6 _chemical_formula_sum 'Mg10 Si12' _cell_volume 433.52557078 _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 0.86555100 0.30587200 0.00733900 1.0 Mg Mg1 1 0.99881800 0.33735500 0.39063700 1.0 Mg Mg2 1 0.65681100 0.74442900 0.27728100 1.0 Mg Mg3 1 0.21985000 0.23822800 0.69653800 1.0 Mg Mg4 1 0.68504700 0.45807500 0.79705800 1.0 Mg Mg5 1 0.95829200 0.79320700 0.04451500 1.0 Mg Mg6 1 0.48927300 0.08942100 0.47376200 1.0 Mg Mg7 1 0.41923300 0.72104600 0.63603400 1.0 Mg Mg8 1 0.46803000 0.00105500 0.91585800 1.0 Mg Mg9 1 0.31675000 0.14664100 0.14727900 1.0 Si Si10 1 0.48246400 0.68295500 0.06709700 1.0 Si Si11 1 0.34360300 0.42495700 0.96891000 1.0 Si Si12 1 0.01132300 0.98198200 0.55817400 1.0 Si Si13 1 0.85531500 0.73235300 0.46565000 1.0 Si Si14 1 0.80795500 0.10918700 0.19845900 1.0 Si Si15 1 0.00136300 0.97689100 0.85124600 1.0 Si Si16 1 0.71348400 0.31076200 0.60734300 1.0 Si Si17 1 0.22662100 0.60004600 0.22120300 1.0 Si Si18 1 0.52853100 0.35512500 0.31335000 1.0 Si Si19 1 0.13543900 0.59616100 0.82410700 1.0 Si Si20 1 0.72922500 0.97761800 0.71751000 1.0 Si Si21 1 0.08339000 0.91300700 0.32428200 1.0