# generated using pymatgen data_Mg16Al13 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.11490525 _cell_length_b 9.11490525 _cell_length_c 9.11490525 _cell_angle_alpha 109.47122063 _cell_angle_beta 109.47122063 _cell_angle_gamma 109.47122063 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg16Al13 _chemical_formula_sum 'Mg16 Al13' _cell_volume 582.95440028 _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 0.31630400 0.00000000 0.60255700 1.0 Mg Mg1 1 0.60255700 0.00000000 0.31630400 1.0 Mg Mg2 1 0.39744300 0.39744300 0.71374700 1.0 Mg Mg3 1 0.71374700 0.39744300 0.39744300 1.0 Mg Mg4 1 0.00000000 0.60255700 0.31630400 1.0 Mg Mg5 1 0.31630400 0.60255700 0.00000000 1.0 Mg Mg6 1 0.65546900 0.65546900 0.65546900 1.0 Mg Mg7 1 0.00000000 0.34453100 0.00000000 1.0 Mg Mg8 1 0.00000000 0.00000000 0.34453100 1.0 Mg Mg9 1 0.34453100 0.00000000 0.00000000 1.0 Mg Mg10 1 0.00000000 0.31630400 0.60255700 1.0 Mg Mg11 1 0.68369600 0.68369600 0.28625300 1.0 Mg Mg12 1 0.60255700 0.31630400 0.00000000 1.0 Mg Mg13 1 0.28625300 0.68369600 0.68369600 1.0 Mg Mg14 1 0.39744300 0.71374700 0.39744300 1.0 Mg Mg15 1 0.68369600 0.28625300 0.68369600 1.0 Al Al16 1 0.00000000 0.00000000 0.00000000 1.0 Al Al17 1 0.18478200 0.18478200 0.81759900 1.0 Al Al18 1 0.00000000 0.81521800 0.63281800 1.0 Al Al19 1 0.81759900 0.18478200 0.18478200 1.0 Al Al20 1 0.63281800 0.81521800 0.00000000 1.0 Al Al21 1 0.36718200 0.18240100 0.36718200 1.0 Al Al22 1 0.18478200 0.81759900 0.18478200 1.0 Al Al23 1 0.81521800 0.00000000 0.63281800 1.0 Al Al24 1 0.63281800 0.00000000 0.81521800 1.0 Al Al25 1 0.18240100 0.36718200 0.36718200 1.0 Al Al26 1 0.36718200 0.36718200 0.18240100 1.0 Al Al27 1 0.81521800 0.63281800 0.00000000 1.0 Al Al28 1 0.00000000 0.63281800 0.81521800 1.0