# generated using pymatgen data_Pr5Bi2Ir _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.40649884 _cell_length_b 9.23554671 _cell_length_c 13.02567511 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pr5Bi2Ir _chemical_formula_sum 'Pr20 Bi8 Ir4' _cell_volume 1011.29534513 _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 Pr Pr0 1 0.34572915 0.75000000 0.70334661 1.0 Pr Pr1 1 0.65427085 0.25000000 0.29665339 1.0 Pr Pr2 1 0.84572915 0.25000000 0.79665339 1.0 Pr Pr3 1 0.15427085 0.75000000 0.20334661 1.0 Pr Pr4 1 0.87733059 0.75000000 0.80333502 1.0 Pr Pr5 1 0.12266941 0.25000000 0.19666498 1.0 Pr Pr6 1 0.37733059 0.25000000 0.69666498 1.0 Pr Pr7 1 0.62266941 0.75000000 0.30333502 1.0 Pr Pr8 1 0.68098923 0.53928587 0.56396513 1.0 Pr Pr9 1 0.31901077 0.46071413 0.43603487 1.0 Pr Pr10 1 0.18098923 0.46071413 0.93603487 1.0 Pr Pr11 1 0.31901077 0.03928587 0.43603487 1.0 Pr Pr12 1 0.81901077 0.53928587 0.06396513 1.0 Pr Pr13 1 0.68098923 0.96071413 0.56396513 1.0 Pr Pr14 1 0.81901077 0.96071413 0.06396513 1.0 Pr Pr15 1 0.18098923 0.03928587 0.93603487 1.0 Pr Pr16 1 0.05003521 0.75000000 0.49762434 1.0 Pr Pr17 1 0.94996479 0.25000000 0.50237566 1.0 Pr Pr18 1 0.55003521 0.25000000 0.00237566 1.0 Pr Pr19 1 0.44996479 0.75000000 0.99762434 1.0 Bi Bi20 1 0.57287101 0.50880550 0.82655821 1.0 Bi Bi21 1 0.42712899 0.49119450 0.17344179 1.0 Bi Bi22 1 0.07287101 0.49119450 0.67344179 1.0 Bi Bi23 1 0.42712899 0.00880550 0.17344179 1.0 Bi Bi24 1 0.92712899 0.50880550 0.32655821 1.0 Bi Bi25 1 0.57287101 0.99119450 0.82655821 1.0 Bi Bi26 1 0.92712899 0.99119450 0.32655821 1.0 Bi Bi27 1 0.07287101 0.00880550 0.67344179 1.0 Ir Ir28 1 0.06661892 0.75000000 0.98969428 1.0 Ir Ir29 1 0.93338108 0.25000000 0.01030572 1.0 Ir Ir30 1 0.56661892 0.25000000 0.51030572 1.0 Ir Ir31 1 0.43338108 0.75000000 0.48969428 1.0