# generated using pymatgen data_Mg16Al13 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.10336669 _cell_length_b 9.10336669 _cell_length_c 9.04638085 _cell_angle_alpha 71.14004784 _cell_angle_beta 71.14004784 _cell_angle_gamma 110.56591807 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg16Al13 _chemical_formula_sum 'Mg16 Al13' _cell_volume 577.88787997 _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 0.00006200 0.00006200 0.99956000 1.0 Mg Mg1 1 0.31684900 0.59988800 0.00185300 1.0 Mg Mg2 1 0.99920600 0.34581200 0.00084900 1.0 Mg Mg3 1 0.34581200 0.99920600 0.00084900 1.0 Mg Mg4 1 0.59988800 0.31684900 0.00185300 1.0 Mg Mg5 1 0.28622900 0.68193100 0.31588100 1.0 Mg Mg6 1 0.68193100 0.28622900 0.31588100 1.0 Mg Mg7 1 0.65085500 0.65085500 0.34581500 1.0 Mg Mg8 1 0.00172800 0.31727700 0.39761800 1.0 Mg Mg9 1 0.31727700 0.00172800 0.39761800 1.0 Mg Mg10 1 0.39810200 0.71494100 0.60151500 1.0 Mg Mg11 1 0.71494100 0.39810200 0.60151500 1.0 Mg Mg12 1 0.00002100 0.00002100 0.65360800 1.0 Mg Mg13 1 0.60135700 0.99991900 0.68363600 1.0 Mg Mg14 1 0.99991900 0.60135700 0.68363600 1.0 Mg Mg15 1 0.68525200 0.68525200 0.71352500 1.0 Al Al16 1 0.63293400 0.81288400 0.99971600 1.0 Al Al17 1 0.81288400 0.63293400 0.99971600 1.0 Al Al18 1 0.19017700 0.19017700 0.18118200 1.0 Al Al19 1 0.63252300 0.99987600 0.18589700 1.0 Al Al20 1 0.99987600 0.63252300 0.18589700 1.0 Al Al21 1 0.39418700 0.39418700 0.28946600 1.0 Al Al22 1 0.81638800 0.99953300 0.36735700 1.0 Al Al23 1 0.99953300 0.81638800 0.36735700 1.0 Al Al24 1 0.18366700 0.36558000 0.63059700 1.0 Al Al25 1 0.36558000 0.18366700 0.63059700 1.0 Al Al26 1 0.81948100 0.18673200 0.81363100 1.0 Al Al27 1 0.18673200 0.81948100 0.81363100 1.0 Al Al28 1 0.36660800 0.36660800 0.81974500 1.0