# generated using pymatgen data_Pr5Nd3(Si3Ir)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.23841342 _cell_length_b 8.23854335 _cell_length_c 8.57059236 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.98822462 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pr5Nd3(Si3Ir)4 _chemical_formula_sum 'Pr5 Nd3 Si12 Ir4' _cell_volume 503.83345771 _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 0.99999902 0.99999905 0.75000000 1.0 Pr Pr1 1 0.00000009 0.99999838 0.25000000 1.0 Pr Pr2 1 0.49988949 0.50011323 0.75000000 1.0 Pr Pr3 1 0.49988973 0.99978109 0.75000000 1.0 Pr Pr4 1 0.00022171 0.50011434 0.75000000 1.0 Nd Nd5 1 0.50012742 0.49987310 0.25000000 1.0 Nd Nd6 1 0.99975106 0.49987585 0.25000000 1.0 Nd Nd7 1 0.50012906 0.00025498 0.25000000 1.0 Si Si8 1 0.83268978 0.16730533 0.00137972 1.0 Si Si9 1 0.83273603 0.66538920 0.00138538 1.0 Si Si10 1 0.33462021 0.16726809 0.00138015 1.0 Si Si11 1 0.83268978 0.16730533 0.49862028 1.0 Si Si12 1 0.83273603 0.66538920 0.49861462 1.0 Si Si13 1 0.33462021 0.16726809 0.49861985 1.0 Si Si14 1 0.16731277 0.83269338 0.49873753 1.0 Si Si15 1 0.66537282 0.83272949 0.49873327 1.0 Si Si16 1 0.16726574 0.33461413 0.49873486 1.0 Si Si17 1 0.16731277 0.83269338 0.00126247 1.0 Si Si18 1 0.66537282 0.83272949 0.00126673 1.0 Si Si19 1 0.16726574 0.33461413 0.00126514 1.0 Ir Ir20 1 0.66667157 0.33333674 0.00173350 1.0 Ir Ir21 1 0.66667157 0.33333674 0.49826650 1.0 Ir Ir22 1 0.33332629 0.66665813 0.49743162 1.0 Ir Ir23 1 0.33332629 0.66665813 0.00256838 1.0