# generated using pymatgen data_Pr(YS2)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.89464123 _cell_length_b 13.16442322 _cell_length_c 13.03499902 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pr(YS2)2 _chemical_formula_sum 'Pr4 Y8 S16' _cell_volume 668.31359558 _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 0.75000000 0.62980386 0.41185867 1.0 Pr Pr1 1 0.25000000 0.37019614 0.58814133 1.0 Pr Pr2 1 0.75000000 0.12980386 0.08814133 1.0 Pr Pr3 1 0.25000000 0.87019614 0.91185867 1.0 Y Y4 1 0.75000000 0.88964576 0.57380443 1.0 Y Y5 1 0.25000000 0.11035424 0.42619557 1.0 Y Y6 1 0.75000000 0.38964576 0.92619557 1.0 Y Y7 1 0.25000000 0.61035424 0.07380443 1.0 Y Y8 1 0.25000000 0.64833522 0.70474150 1.0 Y Y9 1 0.75000000 0.35166478 0.29525850 1.0 Y Y10 1 0.25000000 0.14833522 0.79525850 1.0 Y Y11 1 0.75000000 0.85166478 0.20474150 1.0 S S12 1 0.25000000 0.96748594 0.11647162 1.0 S S13 1 0.75000000 0.03251406 0.88352838 1.0 S S14 1 0.25000000 0.46748594 0.38352838 1.0 S S15 1 0.75000000 0.53251406 0.61647162 1.0 S S16 1 0.75000000 0.74638753 0.02231191 1.0 S S17 1 0.25000000 0.25361247 0.97768809 1.0 S S18 1 0.75000000 0.24638753 0.47768809 1.0 S S19 1 0.25000000 0.75361247 0.52231191 1.0 S S20 1 0.25000000 0.52777641 0.87748472 1.0 S S21 1 0.75000000 0.47222359 0.12251528 1.0 S S22 1 0.25000000 0.02777641 0.62251528 1.0 S S23 1 0.75000000 0.97222359 0.37748472 1.0 S S24 1 0.75000000 0.78559140 0.76178522 1.0 S S25 1 0.25000000 0.21440860 0.23821478 1.0 S S26 1 0.75000000 0.28559140 0.73821478 1.0 S S27 1 0.25000000 0.71440860 0.26178522 1.0