# generated using pymatgen data_Pr3GaPRu2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.63815913 _cell_length_b 7.98025391 _cell_length_c 13.62782655 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pr3GaPRu2 _chemical_formula_sum 'Pr12 Ga4 P4 Ru8' _cell_volume 613.16962912 _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 0.15329139 0.90143362 0.60083265 1.0 Pr Pr1 1 0.84670861 0.09856638 0.10083265 1.0 Pr Pr2 1 0.15329139 0.59856638 0.39916735 1.0 Pr Pr3 1 0.84670861 0.40143362 0.89916735 1.0 Pr Pr4 1 0.84670861 0.09856638 0.39916735 1.0 Pr Pr5 1 0.15329139 0.90143362 0.89916735 1.0 Pr Pr6 1 0.84670861 0.40143362 0.60083265 1.0 Pr Pr7 1 0.15329139 0.59856638 0.10083265 1.0 Pr Pr8 1 0.36097844 0.25752541 0.75000000 1.0 Pr Pr9 1 0.63902156 0.74247459 0.25000000 1.0 Pr Pr10 1 0.36097844 0.24247459 0.25000000 1.0 Pr Pr11 1 0.63902156 0.75752541 0.75000000 1.0 Ga Ga12 1 0.37585907 0.25000000 0.50000000 1.0 Ga Ga13 1 0.62414093 0.75000000 0.00000000 1.0 Ga Ga14 1 0.62414093 0.75000000 0.50000000 1.0 Ga Ga15 1 0.37585907 0.25000000 0.00000000 1.0 P P16 1 0.85151672 0.10850949 0.75000000 1.0 P P17 1 0.14848328 0.89149051 0.25000000 1.0 P P18 1 0.85151672 0.39149051 0.25000000 1.0 P P19 1 0.14848328 0.60850949 0.75000000 1.0 Ru Ru20 1 0.64223601 0.03185154 0.59467021 1.0 Ru Ru21 1 0.35776399 0.96814846 0.09467021 1.0 Ru Ru22 1 0.64223601 0.46814846 0.40532979 1.0 Ru Ru23 1 0.35776399 0.53185154 0.90532979 1.0 Ru Ru24 1 0.35776399 0.96814846 0.40532979 1.0 Ru Ru25 1 0.64223601 0.03185154 0.90532979 1.0 Ru Ru26 1 0.35776399 0.53185154 0.59467021 1.0 Ru Ru27 1 0.64223601 0.46814846 0.09467021 1.0