# generated using pymatgen data_Mg16BeAl12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.98771411 _cell_length_b 8.98771411 _cell_length_c 8.98771409 _cell_angle_alpha 108.67933693 _cell_angle_beta 108.67933693 _cell_angle_gamma 108.67933768 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg16BeAl12 _chemical_formula_sum 'Mg16 Be1 Al12' _cell_volume 574.69124321 _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 0.58054900 0.58054900 0.29948200 1.0 Mg Mg1 1 0.31720300 0.31720300 0.72017600 1.0 Mg Mg2 1 0.00305900 0.00305900 0.65319700 1.0 Mg Mg3 1 0.99645600 0.99645600 0.99645600 1.0 Mg Mg4 1 0.68282100 0.40489500 0.00439300 1.0 Mg Mg5 1 0.58054900 0.29948200 0.58054900 1.0 Mg Mg6 1 0.00439300 0.68282100 0.40489500 1.0 Mg Mg7 1 0.00305900 0.65319700 0.00305900 1.0 Mg Mg8 1 0.40489500 0.00439300 0.68282100 1.0 Mg Mg9 1 0.72017600 0.31720300 0.31720300 1.0 Mg Mg10 1 0.31720300 0.72017600 0.31720300 1.0 Mg Mg11 1 0.00439300 0.40489500 0.68282100 1.0 Mg Mg12 1 0.65319700 0.00305900 0.00305900 1.0 Mg Mg13 1 0.68282100 0.00439300 0.40489500 1.0 Mg Mg14 1 0.29948200 0.58054900 0.58054900 1.0 Mg Mg15 1 0.40489500 0.68282100 0.00439300 1.0 Be Be16 1 0.27866300 0.27866300 0.27866300 1.0 Al Al17 1 0.64467900 0.64467900 0.83431600 1.0 Al Al18 1 0.81668700 0.81668700 0.19517500 1.0 Al Al19 1 0.36666200 0.18513700 0.00519200 1.0 Al Al20 1 0.18513700 0.00519200 0.36666200 1.0 Al Al21 1 0.83431600 0.64467900 0.64467900 1.0 Al Al22 1 0.36666200 0.00519200 0.18513700 1.0 Al Al23 1 0.19517500 0.81668700 0.81668700 1.0 Al Al24 1 0.81668700 0.19517500 0.81668700 1.0 Al Al25 1 0.00519200 0.36666200 0.18513700 1.0 Al Al26 1 0.64467900 0.83431600 0.64467900 1.0 Al Al27 1 0.00519200 0.18513700 0.36666200 1.0 Al Al28 1 0.18513700 0.36666200 0.00519200 1.0