# generated using pymatgen data_Er5Ir3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.29610718 _cell_length_b 10.71740512 _cell_length_c 10.71740308 _cell_angle_alpha 90.00002181 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Er5Ir3 _chemical_formula_sum 'Er20 Ir12' _cell_volume 723.18818904 _cell_formula_units_Z 4 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 Er Er0 1 0.50000000 0.50000000 0.50000000 1.0 Er Er1 1 -0.00000000 0.50000000 0.50000000 1.0 Er Er2 1 0.49999900 0.00000000 -0.00000000 1.0 Er Er3 1 -0.00000000 0.00000000 -0.00000000 1.0 Er Er4 1 0.38162095 0.58765512 0.79164634 1.0 Er Er5 1 0.88162095 0.58765512 0.20835266 1.0 Er Er6 1 0.61838006 0.91234134 0.70834605 1.0 Er Er7 1 0.11838106 0.08765966 0.70834605 1.0 Er Er8 1 0.38162095 0.41234488 0.20835366 1.0 Er Er9 1 0.88162095 0.41234488 0.79164734 1.0 Er Er10 1 0.61838006 0.08765866 0.29165395 1.0 Er Er11 1 0.11838106 0.91234034 0.29165395 1.0 Er Er12 1 0.61837905 0.79164734 0.41234388 1.0 Er Er13 1 0.11837805 0.20835366 0.41234488 1.0 Er Er14 1 0.38161994 0.29165295 0.91233934 1.0 Er Er15 1 0.88161994 0.70834705 0.91234034 1.0 Er Er16 1 0.61837905 0.20835266 0.58765612 1.0 Er Er17 1 0.11837805 0.79164634 0.58765512 1.0 Er Er18 1 0.38161994 0.70834705 0.08766066 1.0 Er Er19 1 0.88161994 0.29165295 0.08765966 1.0 Ir Ir20 1 0.37209482 0.00000000 0.50000000 1.0 Ir Ir21 1 0.87209482 0.00000000 0.50000000 1.0 Ir Ir22 1 0.62790518 0.50000000 -0.00000000 1.0 Ir Ir23 1 0.12790518 0.50000000 -0.00000000 1.0 Ir Ir24 1 0.75000000 0.65357939 0.65357939 1.0 Ir Ir25 1 0.25000000 0.65357939 0.34642061 1.0 Ir Ir26 1 0.25000000 0.84641157 0.84641157 1.0 Ir Ir27 1 0.75000000 0.15358843 0.84641157 1.0 Ir Ir28 1 0.75000000 0.34642061 0.34642061 1.0 Ir Ir29 1 0.25000000 0.34642061 0.65357939 1.0 Ir Ir30 1 0.25000000 0.15358843 0.15358843 1.0 Ir Ir31 1 0.75000000 0.84641157 0.15358843 1.0