# generated using pymatgen data_Mg16Al12Ni _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.20516571 _cell_length_b 8.98550495 _cell_length_c 8.98550660 _cell_angle_alpha 108.97072871 _cell_angle_beta 109.96718650 _cell_angle_gamma 109.96718418 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg16Al12Ni _chemical_formula_sum 'Mg16 Al12 Ni1' _cell_volume 568.59084620 _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 0.00207000 0.35224000 0.00000000 1.0 Mg Mg1 1 0.57516800 0.27062200 0.00000000 1.0 Mg Mg2 1 0.99050900 0.00000000 0.00000000 1.0 Mg Mg3 1 0.31917100 0.59381300 0.00000100 1.0 Mg Mg4 1 0.57516700 0.00000000 0.27062200 1.0 Mg Mg5 1 0.68367200 0.67539400 0.27818600 1.0 Mg Mg6 1 0.00827900 0.60279200 0.32460600 1.0 Mg Mg7 1 0.00207000 0.00000000 0.35224000 1.0 Mg Mg8 1 0.40548700 0.72181500 0.39720900 1.0 Mg Mg9 1 0.72535700 0.40618700 0.40618700 1.0 Mg Mg10 1 0.31917100 0.00000000 0.59381400 1.0 Mg Mg11 1 0.00827800 0.32460600 0.60279200 1.0 Mg Mg12 1 0.64982900 0.64775800 0.64775800 1.0 Mg Mg13 1 0.68367300 0.27818600 0.67539400 1.0 Mg Mg14 1 0.40548700 0.39720900 0.72181500 1.0 Mg Mg15 1 0.30454500 0.72937800 0.72937800 1.0 Al Al16 1 0.64802600 0.81023100 0.99999900 1.0 Al Al17 1 0.81350200 0.61564700 0.00000000 1.0 Al Al18 1 0.36610300 0.35873600 0.18027800 1.0 Al Al19 1 0.18582500 0.81972100 0.17845700 1.0 Al Al20 1 0.83779300 0.18976800 0.18976700 1.0 Al Al21 1 0.36610400 0.18027800 0.35873600 1.0 Al Al22 1 0.19785500 0.38435300 0.38435400 1.0 Al Al23 1 0.81350200 0.00000000 0.61564700 1.0 Al Al24 1 0.00736700 0.82154300 0.64126500 1.0 Al Al25 1 0.64802500 0.99999900 0.81023200 1.0 Al Al26 1 0.00736700 0.64126500 0.82154300 1.0 Al Al27 1 0.18582400 0.17845700 0.81972200 1.0 Ni Ni28 1 0.26477900 0.99999900 0.00000000 1.0