# generated using pymatgen data_Li2Sc(Ru2W)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.30985173 _cell_length_b 6.13129110 _cell_length_c 12.91841224 _cell_angle_alpha 89.99991791 _cell_angle_beta 89.99921930 _cell_angle_gamma 89.99980010 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li2Sc(Ru2W)3 _chemical_formula_sum 'Li4 Sc2 Ru12 W6' _cell_volume 341.36846903 _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 Li Li0 1 0.99990950 0.50000907 0.33662528 1.0 Li Li1 1 0.50001397 0.99999258 0.50162149 1.0 Li Li2 1 0.00014218 0.50000052 0.66468214 1.0 Li Li3 1 0.50004428 0.99999300 0.82973428 1.0 Sc Sc4 1 0.99996779 0.49999557 0.99722971 1.0 Sc Sc5 1 0.49992395 0.99999780 0.16951038 1.0 Ru Ru6 1 0.49997632 0.24678689 0.99752183 1.0 Ru Ru7 1 0.49997571 0.75320367 0.99752297 1.0 Ru Ru8 1 0.99992356 0.25314466 0.16914043 1.0 Ru Ru9 1 0.99992471 0.74684084 0.16913818 1.0 Ru Ru10 1 0.49995934 0.25193535 0.33783678 1.0 Ru Ru11 1 0.49996017 0.74806439 0.33783465 1.0 Ru Ru12 1 0.00002855 0.25108044 0.50150413 1.0 Ru Ru13 1 0.00002846 0.74892552 0.50150427 1.0 Ru Ru14 1 0.50006597 0.24893109 0.66521448 1.0 Ru Ru15 1 0.50007076 0.75106777 0.66521624 1.0 Ru Ru16 1 0.00002419 0.24804086 0.82892218 1.0 Ru Ru17 1 0.00002663 0.75195393 0.82892304 1.0 W W18 1 0.99998008 0.99999710 0.99000899 1.0 W W19 1 0.49998254 0.49999841 0.17681474 1.0 W W20 1 0.99982717 0.00000206 0.34549512 1.0 W W21 1 0.50002819 0.50000849 0.50355263 1.0 W W22 1 0.00018994 0.00001275 0.66316937 1.0 W W23 1 0.50003302 0.50000826 0.82127567 1.0