# generated using pymatgen data_Na5Si9P3Ir19 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.63103634 _cell_length_b 12.63103684 _cell_length_c 3.93800058 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999357 _symmetry_Int_Tables_number 1 _chemical_formula_structural Na5Si9P3Ir19 _chemical_formula_sum 'Na5 Si9 P3 Ir19' _cell_volume 544.10713612 _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 Na Na0 1 0.33333300 0.66666700 0.50000000 1.0 Na Na1 1 0.66666700 0.33333300 0.50000000 1.0 Na Na2 1 1.00000000 0.81973844 0.00000000 1.0 Na Na3 1 0.18026156 0.18026156 0.00000000 1.0 Na Na4 1 0.81973844 1.00000000 0.00000000 1.0 Si Si5 1 0.00000000 0.63114495 0.50000000 1.0 Si Si6 1 0.36885505 0.36885505 0.50000000 1.0 Si Si7 1 0.63114495 0.00000000 0.50000000 1.0 Si Si8 1 0.51981673 0.68675831 0.00000000 1.0 Si Si9 1 0.31324169 0.83305942 0.00000000 1.0 Si Si10 1 0.16694058 0.48018327 0.00000000 1.0 Si Si11 1 0.48018327 0.16694058 0.00000000 1.0 Si Si12 1 0.68675831 0.51981673 0.00000000 1.0 Si Si13 1 0.83305942 0.31324169 0.00000000 1.0 P P14 1 1.00000000 0.17922436 0.50000000 1.0 P P15 1 0.82077564 0.82077564 0.50000000 1.0 P P16 1 0.17922436 1.00000000 0.50000000 1.0 Ir Ir17 1 0.51445894 0.87423977 0.00000000 1.0 Ir Ir18 1 0.12576023 0.64021918 0.00000000 1.0 Ir Ir19 1 0.35978082 0.48554106 0.00000000 1.0 Ir Ir20 1 0.48554106 0.35978082 0.00000000 1.0 Ir Ir21 1 0.87423977 0.51445894 0.00000000 1.0 Ir Ir22 1 0.64021918 0.12576023 0.00000000 1.0 Ir Ir23 1 1.00000000 0.44545692 0.50000000 1.0 Ir Ir24 1 0.55454308 0.55454308 0.50000000 1.0 Ir Ir25 1 0.44545692 1.00000000 0.50000000 1.0 Ir Ir26 1 1.00000000 0.27799817 0.00000000 1.0 Ir Ir27 1 0.72200183 0.72200183 0.00000000 1.0 Ir Ir28 1 0.27799817 1.00000000 0.00000000 1.0 Ir Ir29 1 0.62516435 0.80716489 0.50000000 1.0 Ir Ir30 1 0.19283511 0.81799946 0.50000000 1.0 Ir Ir31 1 0.18200054 0.37483565 0.50000000 1.0 Ir Ir32 1 0.37483565 0.18200054 0.50000000 1.0 Ir Ir33 1 0.80716489 0.62516435 0.50000000 1.0 Ir Ir34 1 0.81799946 0.19283511 0.50000000 1.0 Ir Ir35 1 0.00000000 0.00000000 0.50000000 1.0