# generated using pymatgen data_Pr3PtCl3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.31966205 _cell_length_b 10.31966245 _cell_length_c 10.31966183 _cell_angle_alpha 109.47121559 _cell_angle_beta 109.47121637 _cell_angle_gamma 109.47122411 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pr3PtCl3 _chemical_formula_sum 'Pr12 Pt4 Cl12' _cell_volume 846.00820277 _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 0.48090440 0.49045220 0.24045220 1.0 Pr Pr1 1 0.75000000 0.24045220 0.25954780 1.0 Pr Pr2 1 0.75000000 0.00954780 0.49045220 1.0 Pr Pr3 1 0.24045220 0.48090440 0.49045220 1.0 Pr Pr4 1 0.25954780 0.75000000 0.24045220 1.0 Pr Pr5 1 0.01909560 0.25954780 0.00954780 1.0 Pr Pr6 1 0.00954780 0.01909560 0.25954780 1.0 Pr Pr7 1 0.49045220 0.75000000 0.00954780 1.0 Pr Pr8 1 0.49045220 0.24045220 0.48090440 1.0 Pr Pr9 1 0.00954780 0.49045220 0.75000000 1.0 Pr Pr10 1 0.25954780 0.00954780 0.01909560 1.0 Pr Pr11 1 0.24045220 0.25954780 0.75000000 1.0 Pt Pt12 1 0.25000000 0.25000000 0.25000000 1.0 Pt Pt13 1 0.50000000 0.00000000 0.25000000 1.0 Pt Pt14 1 0.00000000 0.25000000 0.50000000 1.0 Pt Pt15 1 0.25000000 0.50000000 0.00000000 1.0 Cl Cl16 1 0.25000000 0.75030448 0.74969552 1.0 Cl Cl17 1 0.50060895 0.50030448 0.75030448 1.0 Cl Cl18 1 0.99939105 0.74969552 0.99969552 1.0 Cl Cl19 1 0.74969552 0.25000000 0.75030448 1.0 Cl Cl20 1 0.99969552 0.99939105 0.74969552 1.0 Cl Cl21 1 0.25000000 0.99969552 0.50030448 1.0 Cl Cl22 1 0.75030448 0.50060895 0.50030448 1.0 Cl Cl23 1 0.50030448 0.25000000 0.99969552 1.0 Cl Cl24 1 0.75030448 0.74969552 0.25000000 1.0 Cl Cl25 1 0.74969552 0.99969552 0.99939105 1.0 Cl Cl26 1 0.99969552 0.50030448 0.25000000 1.0 Cl Cl27 1 0.50030448 0.75030448 0.50060895 1.0