# generated using pymatgen data_Pr2Sb4Ir3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.60053200 _cell_length_b 11.09165200 _cell_length_c 16.34323400 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pr2Sb4Ir3 _chemical_formula_sum 'Pr8 Sb16 Ir12' _cell_volume 833.95437226 _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 0.25000000 0.74851200 0.50670600 1.0 Pr Pr1 1 0.25000000 0.75148800 0.00670600 1.0 Pr Pr2 1 0.75000000 0.25148800 0.49329400 1.0 Pr Pr3 1 0.75000000 0.24851200 0.99329400 1.0 Pr Pr4 1 0.25000000 0.58952400 0.75133700 1.0 Pr Pr5 1 0.25000000 0.91047600 0.25133700 1.0 Pr Pr6 1 0.75000000 0.41047600 0.24866300 1.0 Pr Pr7 1 0.75000000 0.08952400 0.74866300 1.0 Sb Sb8 1 0.25000000 0.27557300 0.64967000 1.0 Sb Sb9 1 0.25000000 0.22442700 0.14967000 1.0 Sb Sb10 1 0.75000000 0.72442700 0.35033000 1.0 Sb Sb11 1 0.75000000 0.77557300 0.85033000 1.0 Sb Sb12 1 0.25000000 0.88673900 0.71020500 1.0 Sb Sb13 1 0.25000000 0.61326100 0.21020500 1.0 Sb Sb14 1 0.75000000 0.11326100 0.28979500 1.0 Sb Sb15 1 0.75000000 0.38673900 0.78979500 1.0 Sb Sb16 1 0.25000000 0.06283500 0.89455100 1.0 Sb Sb17 1 0.25000000 0.43716500 0.39455100 1.0 Sb Sb18 1 0.75000000 0.93716500 0.10544900 1.0 Sb Sb19 1 0.75000000 0.56283500 0.60544900 1.0 Sb Sb20 1 0.25000000 0.44764200 0.93151500 1.0 Sb Sb21 1 0.25000000 0.05235800 0.43151500 1.0 Sb Sb22 1 0.75000000 0.55235800 0.06848500 1.0 Sb Sb23 1 0.75000000 0.94764200 0.56848500 1.0 Ir Ir24 1 0.25000000 0.46632100 0.55627000 1.0 Ir Ir25 1 0.25000000 0.03367900 0.05627000 1.0 Ir Ir26 1 0.75000000 0.53367900 0.44373000 1.0 Ir Ir27 1 0.75000000 0.96632100 0.94373000 1.0 Ir Ir28 1 0.25000000 0.05645200 0.59215500 1.0 Ir Ir29 1 0.25000000 0.44354800 0.09215500 1.0 Ir Ir30 1 0.75000000 0.94354800 0.40784500 1.0 Ir Ir31 1 0.75000000 0.55645200 0.90784500 1.0 Ir Ir32 1 0.25000000 0.27742400 0.81763800 1.0 Ir Ir33 1 0.25000000 0.22257600 0.31763800 1.0 Ir Ir34 1 0.75000000 0.72257600 0.18236200 1.0 Ir Ir35 1 0.75000000 0.77742400 0.68236200 1.0