# generated using pymatgen data_Mg5Si8P4Ir19 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.66985282 _cell_length_b 12.62519331 _cell_length_c 3.86856324 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.89812402 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg5Si8P4Ir19 _chemical_formula_sum 'Mg5 Si8 P4 Ir19' _cell_volume 536.45692721 _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 0.66684971 0.33329939 0.00000000 1.0 Mg Mg1 1 0.33806720 0.67595795 0.00000000 1.0 Mg Mg2 1 0.81928959 0.81819679 0.50000000 1.0 Mg Mg3 1 0.18043396 0.00013783 0.50000000 1.0 Mg Mg4 1 0.99546941 0.17496352 0.50000000 1.0 Si Si5 1 0.68452678 0.16347437 0.50000000 1.0 Si Si6 1 0.83621289 0.52002695 0.50000000 1.0 Si Si7 1 0.48049993 0.31618310 0.50000000 1.0 Si Si8 1 0.16633898 0.68639769 0.50000000 1.0 Si Si9 1 0.51830592 0.83198529 0.50000000 1.0 Si Si10 1 0.63536406 0.63352949 0.00000000 1.0 Si Si11 1 0.36616402 0.00044051 0.00000000 1.0 Si Si12 1 0.99929631 0.36446611 0.00000000 1.0 P P13 1 0.30830745 0.48264138 0.50000000 1.0 P P14 1 0.17799176 0.17839360 0.00000000 1.0 P P15 1 0.82186818 0.99594120 0.00000000 1.0 P P16 1 0.00108169 0.82498388 0.00000000 1.0 Ir Ir17 1 0.81112388 0.17863816 0.00000000 1.0 Ir Ir18 1 0.82064018 0.63110547 0.00000000 1.0 Ir Ir19 1 0.36856226 0.18892736 0.00000000 1.0 Ir Ir20 1 0.18181625 0.81036144 0.00000000 1.0 Ir Ir21 1 0.62569145 0.81455464 0.00000000 1.0 Ir Ir22 1 0.19530317 0.37779775 0.00000000 1.0 Ir Ir23 1 0.45371476 0.44528604 0.00000000 1.0 Ir Ir24 1 0.55289943 0.00058400 0.00000000 1.0 Ir Ir25 1 0.99923588 0.55132470 0.00000000 1.0 Ir Ir26 1 0.27808103 0.28342514 0.50000000 1.0 Ir Ir27 1 0.72215521 0.99640124 0.50000000 1.0 Ir Ir28 1 0.00110582 0.72475839 0.50000000 1.0 Ir Ir29 1 0.86891248 0.35639756 0.50000000 1.0 Ir Ir30 1 0.64418785 0.51185200 0.50000000 1.0 Ir Ir31 1 0.48896215 0.13158634 0.50000000 1.0 Ir Ir32 1 0.35923192 0.87025189 0.50000000 1.0 Ir Ir33 1 0.50129173 0.63445716 0.50000000 1.0 Ir Ir34 1 0.12936682 0.48880446 0.50000000 1.0 Ir Ir35 1 0.00164991 0.00246825 0.00000000 1.0