# generated using pymatgen data_Mg3Au13 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.07808147 _cell_length_b 4.07808147 _cell_length_c 16.69720292 _cell_angle_alpha 90.00000000 _cell_angle_beta 89.99999286 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg3Au13 _chemical_formula_sum 'Mg3 Au13' _cell_volume 277.68698201 _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 1.00000000 -0.00000000 0.87178785 1.0 Mg Mg1 1 1.00000000 -0.00000000 0.12594565 1.0 Mg Mg2 1 0.50000000 0.50000000 0.62541629 1.0 Au Au3 1 0.50000000 -0.00000000 0.00030945 1.0 Au Au4 1 0.00000000 0.50000000 0.50300206 1.0 Au Au5 1 0.50000000 0.00000000 0.50300206 1.0 Au Au6 1 1.00000000 0.50000000 0.00030945 1.0 Au Au7 1 0.50000000 0.50000000 0.12381545 1.0 Au Au8 1 1.00000000 -0.00000000 0.62522264 1.0 Au Au9 1 1.00000000 -0.00000000 0.37818970 1.0 Au Au10 1 0.50000000 0.50000000 0.87705658 1.0 Au Au11 1 1.00000000 0.50000000 0.24711671 1.0 Au Au12 1 0.50000000 0.00000000 0.74988938 1.0 Au Au13 1 0.50000000 -0.00000000 0.24711671 1.0 Au Au14 1 0.00000000 0.50000000 0.74988938 1.0 Au Au15 1 0.50000000 0.50000000 0.37193165 1.0