# generated using pymatgen data_Pr2Si(PRu2)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.44211175 _cell_length_b 9.44211346 _cell_length_c 3.96022371 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999656 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pr2Si(PRu2)6 _chemical_formula_sum 'Pr2 Si1 P6 Ru12' _cell_volume 305.76566549 _cell_formula_units_Z 1 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 0.33333300 0.66666700 0.00000000 1.0 Pr Pr1 1 0.66666700 0.33333300 0.50000000 1.0 Si Si2 1 0.00000000 0.00000000 0.00000000 1.0 P P3 1 0.10847514 0.39185802 0.50000000 1.0 P P4 1 0.60814198 0.71661711 0.50000000 1.0 P P5 1 0.28338289 0.89152486 0.50000000 1.0 P P6 1 0.42012501 0.31251800 0.00000000 1.0 P P7 1 0.68748200 0.10760701 0.00000000 1.0 P P8 1 0.89239299 0.57987499 0.00000000 1.0 Ru Ru9 1 0.42207594 0.06593897 0.00000000 1.0 Ru Ru10 1 0.93406103 0.35613597 0.00000000 1.0 Ru Ru11 1 0.64386403 0.57792406 0.00000000 1.0 Ru Ru12 1 0.39316524 0.44113941 0.50000000 1.0 Ru Ru13 1 0.55886059 0.95202482 0.50000000 1.0 Ru Ru14 1 0.04797518 0.60683476 0.50000000 1.0 Ru Ru15 1 0.16258497 0.27660405 0.00000000 1.0 Ru Ru16 1 0.72339595 0.88597992 0.00000000 1.0 Ru Ru17 1 0.11402008 0.83741503 0.00000000 1.0 Ru Ru18 1 0.20611626 0.08838298 0.50000000 1.0 Ru Ru19 1 0.91161702 0.11773527 0.50000000 1.0 Ru Ru20 1 0.88226473 0.79388374 0.50000000 1.0