# generated using pymatgen data_Pr7Er(Si3Ir)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.23422077 _cell_length_b 8.22195790 _cell_length_c 8.53544549 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.04886436 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pr7Er(Si3Ir)4 _chemical_formula_sum 'Pr7 Er1 Si12 Ir4' _cell_volume 500.19636058 _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 Pr Pr0 1 0.99998912 0.99997624 0.25000000 1.0 Pr Pr1 1 0.00001675 0.00003050 0.75000000 1.0 Pr Pr2 1 0.49991111 0.50003266 0.25000000 1.0 Pr Pr3 1 0.49988170 0.99976239 0.25000000 1.0 Pr Pr4 1 0.00011755 0.50003166 0.25000000 1.0 Pr Pr5 1 0.50002035 0.49987877 0.75000000 1.0 Pr Pr6 1 0.99986441 0.49988077 0.75000000 1.0 Er Er7 1 0.50018320 0.00036740 0.75000000 1.0 Si Si8 1 0.83166671 0.16620940 0.50351141 1.0 Si Si9 1 0.83249710 0.66499621 0.49935462 1.0 Si Si10 1 0.33454269 0.16621040 0.50351041 1.0 Si Si11 1 0.83166671 0.16620940 0.99648859 1.0 Si Si12 1 0.83249710 0.66499621 0.00064538 1.0 Si Si13 1 0.33454269 0.16621040 0.99648959 1.0 Si Si14 1 0.16834158 0.83378801 0.99581075 1.0 Si Si15 1 0.66544543 0.83378801 0.99580975 1.0 Si Si16 1 0.16751354 0.33502608 0.00024953 1.0 Si Si17 1 0.16834158 0.83378801 0.50418925 1.0 Si Si18 1 0.66544543 0.83378801 0.50419025 1.0 Si Si19 1 0.16751354 0.33502608 0.49975047 1.0 Ir Ir20 1 0.66526971 0.33053842 0.50511468 1.0 Ir Ir21 1 0.66526971 0.33053842 0.99488532 1.0 Ir Ir22 1 0.33473015 0.66946231 0.99500429 1.0 Ir Ir23 1 0.33473015 0.66946231 0.50499571 1.0