# generated using pymatgen data_Mg5Ta6Ru12W _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.41990121 _cell_length_b 6.23274409 _cell_length_c 13.21320084 _cell_angle_alpha 90.00000000 _cell_angle_beta 89.99977269 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg5Ta6Ru12W _chemical_formula_sum 'Mg5 Ta6 Ru12 W1' _cell_volume 363.99875124 _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 Mg Mg0 1 0.49996179 0.00000000 0.16762399 1.0 Mg Mg1 1 0.99999759 0.50000100 0.33462190 1.0 Mg Mg2 1 0.49999900 0.00000000 0.50000000 1.0 Mg Mg3 1 0.00000241 0.50000100 0.66537810 1.0 Mg Mg4 1 0.50003821 0.00000000 0.83237601 1.0 Ta Ta5 1 0.00000000 0.00000000 0.00000000 1.0 Ta Ta6 1 0.50000003 0.50000100 0.17477279 1.0 Ta Ta7 1 0.99999508 0.00000000 0.33664244 1.0 Ta Ta8 1 0.49999900 0.50000100 0.50000000 1.0 Ta Ta9 1 0.00000492 0.00000000 0.66335756 1.0 Ta Ta10 1 0.49999997 0.50000100 0.82522721 1.0 Ru Ru11 1 0.49999900 0.25890223 0.00000000 1.0 Ru Ru12 1 0.49999900 0.74109777 0.00000000 1.0 Ru Ru13 1 0.99999374 0.25451458 0.16063956 1.0 Ru Ru14 1 0.99999374 0.74548542 0.16063956 1.0 Ru Ru15 1 0.49999672 0.24875505 0.33219550 1.0 Ru Ru16 1 0.49999672 0.75124495 0.33219550 1.0 Ru Ru17 1 0.00000000 0.24917536 0.50000000 1.0 Ru Ru18 1 0.00000000 0.75082464 0.50000000 1.0 Ru Ru19 1 0.50000328 0.24875505 0.66780450 1.0 Ru Ru20 1 0.50000328 0.75124495 0.66780450 1.0 Ru Ru21 1 0.00000626 0.25451458 0.83936044 1.0 Ru Ru22 1 0.00000626 0.74548542 0.83936044 1.0 W W23 1 0.00000000 0.50000100 0.00000000 1.0