# generated using pymatgen data_Pr7Ru3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.71186077 _cell_length_b 7.33254909 _cell_length_c 23.40115774 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pr7Ru3 _chemical_formula_sum 'Pr28 Ru12' _cell_volume 1151.68911503 _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 0.31850833 0.81574776 0.17444368 1.0 Pr Pr1 1 0.18149167 0.31574776 0.32555632 1.0 Pr Pr2 1 0.68149167 0.18425224 0.67444368 1.0 Pr Pr3 1 0.81850833 0.68425224 0.82555632 1.0 Pr Pr4 1 0.68149167 0.18425224 0.82555632 1.0 Pr Pr5 1 0.81850833 0.68425224 0.67444368 1.0 Pr Pr6 1 0.31850833 0.81574776 0.32555632 1.0 Pr Pr7 1 0.18149167 0.31574776 0.17444368 1.0 Pr Pr8 1 0.32529665 0.82218023 0.02319264 1.0 Pr Pr9 1 0.17470335 0.32218023 0.47680736 1.0 Pr Pr10 1 0.67470335 0.17781977 0.52319264 1.0 Pr Pr11 1 0.82529665 0.67781977 0.97680736 1.0 Pr Pr12 1 0.67470335 0.17781977 0.97680736 1.0 Pr Pr13 1 0.82529665 0.67781977 0.52319264 1.0 Pr Pr14 1 0.32529665 0.82218023 0.47680736 1.0 Pr Pr15 1 0.17470335 0.32218023 0.02319264 1.0 Pr Pr16 1 0.86288520 0.67384013 0.25000000 1.0 Pr Pr17 1 0.63711480 0.17384013 0.25000000 1.0 Pr Pr18 1 0.13711480 0.32615987 0.75000000 1.0 Pr Pr19 1 0.36288520 0.82615987 0.75000000 1.0 Pr Pr20 1 0.85669575 0.94567496 0.11460171 1.0 Pr Pr21 1 0.64330425 0.44567496 0.38539829 1.0 Pr Pr22 1 0.14330425 0.05432504 0.61460171 1.0 Pr Pr23 1 0.35669575 0.55432504 0.88539829 1.0 Pr Pr24 1 0.14330425 0.05432504 0.88539829 1.0 Pr Pr25 1 0.35669575 0.55432504 0.61460171 1.0 Pr Pr26 1 0.85669575 0.94567496 0.38539829 1.0 Pr Pr27 1 0.64330425 0.44567496 0.11460171 1.0 Ru Ru28 1 0.47010661 0.52358944 0.25000000 1.0 Ru Ru29 1 0.02989339 0.02358944 0.25000000 1.0 Ru Ru30 1 0.52989339 0.47641056 0.75000000 1.0 Ru Ru31 1 0.97010661 0.97641056 0.75000000 1.0 Ru Ru32 1 0.03022880 0.60726882 0.09553862 1.0 Ru Ru33 1 0.46977120 0.10726882 0.40446138 1.0 Ru Ru34 1 0.96977120 0.39273118 0.59553862 1.0 Ru Ru35 1 0.53022880 0.89273118 0.90446138 1.0 Ru Ru36 1 0.96977120 0.39273118 0.90446138 1.0 Ru Ru37 1 0.53022880 0.89273118 0.59553862 1.0 Ru Ru38 1 0.03022880 0.60726882 0.40446138 1.0 Ru Ru39 1 0.46977120 0.10726882 0.09553862 1.0