# generated using pymatgen data_Be3Si(PRu3)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.00299695 _cell_length_b 5.65409169 _cell_length_c 12.01469417 _cell_angle_alpha 90.00000000 _cell_angle_beta 89.99990787 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Be3Si(PRu3)2 _chemical_formula_sum 'Be6 Si2 P4 Ru12' _cell_volume 271.93231920 _cell_formula_units_Z 2 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 Be Be0 1 0.99999737 0.00000000 0.99499613 1.0 Be Be1 1 0.49999674 0.50000100 0.16699104 1.0 Be Be2 1 0.99999675 0.00000000 0.33300219 1.0 Be Be3 1 0.49999657 0.50000100 0.50499495 1.0 Be Be4 1 0.00000577 0.00000000 0.67585290 1.0 Be Be5 1 0.50000877 0.50000100 0.82417960 1.0 Si Si6 1 0.00002904 0.50000100 0.66609805 1.0 Si Si7 1 0.50002603 0.00000000 0.83391622 1.0 P P8 1 0.99999066 0.50000100 0.00098987 1.0 P P9 1 0.49998003 0.00000000 0.16622512 1.0 P P10 1 0.99998746 0.50000100 0.33374625 1.0 P P11 1 0.49998434 0.00000000 0.49901873 1.0 Ru Ru12 1 0.49999830 0.25230970 0.00522921 1.0 Ru Ru13 1 0.49999830 0.74769230 0.00522921 1.0 Ru Ru14 1 0.99999108 0.24983874 0.16838049 1.0 Ru Ru15 1 0.99999108 0.75016126 0.16838049 1.0 Ru Ru16 1 0.49999183 0.25011417 0.33164810 1.0 Ru Ru17 1 0.49999183 0.74988783 0.33164810 1.0 Ru Ru18 1 0.99999536 0.24771364 0.49472446 1.0 Ru Ru19 1 0.99999536 0.75228636 0.49472446 1.0 Ru Ru20 1 0.50001104 0.24533949 0.66257096 1.0 Ru Ru21 1 0.50001104 0.75466251 0.66257096 1.0 Ru Ru22 1 0.00001113 0.25468856 0.83744226 1.0 Ru Ru23 1 0.00001113 0.74531144 0.83744226 1.0