# generated using pymatgen data_P3Ru4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 2.94768256 _cell_length_b 10.46798580 _cell_length_c 12.29617138 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural P3Ru4 _chemical_formula_sum 'P12 Ru16' _cell_volume 379.41434290 _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 P P0 1 0.75000000 0.92040993 0.62016012 1.0 P P1 1 0.75000000 0.07471267 0.87851299 1.0 P P2 1 0.75000000 0.24497617 0.63975026 1.0 P P3 1 0.25000000 0.07959007 0.37983988 1.0 P P4 1 0.25000000 0.74497617 0.86024974 1.0 P P5 1 0.25000000 0.57471267 0.62148701 1.0 P P6 1 0.25000000 0.92528733 0.12148701 1.0 P P7 1 0.75000000 0.57959007 0.12016012 1.0 P P8 1 0.25000000 0.42040993 0.87983988 1.0 P P9 1 0.75000000 0.25502383 0.13975026 1.0 P P10 1 0.75000000 0.42528733 0.37851299 1.0 P P11 1 0.25000000 0.75502383 0.36024974 1.0 Ru Ru12 1 0.25000000 0.93988473 0.77026692 1.0 Ru Ru13 1 0.25000000 0.40424736 0.06696850 1.0 Ru Ru14 1 0.75000000 0.88013726 0.97197117 1.0 Ru Ru15 1 0.75000000 0.59575264 0.93303150 1.0 Ru Ru16 1 0.25000000 0.28286772 0.29887440 1.0 Ru Ru17 1 0.25000000 0.38013726 0.52802883 1.0 Ru Ru18 1 0.75000000 0.06011527 0.22973308 1.0 Ru Ru19 1 0.25000000 0.09575264 0.56696850 1.0 Ru Ru20 1 0.25000000 0.56011527 0.27026692 1.0 Ru Ru21 1 0.75000000 0.61986274 0.47197117 1.0 Ru Ru22 1 0.75000000 0.90424736 0.43303150 1.0 Ru Ru23 1 0.75000000 0.43988473 0.72973308 1.0 Ru Ru24 1 0.25000000 0.11986274 0.02802883 1.0 Ru Ru25 1 0.75000000 0.78286772 0.20112560 1.0 Ru Ru26 1 0.75000000 0.71713228 0.70112560 1.0 Ru Ru27 1 0.25000000 0.21713228 0.79887440 1.0