# generated using pymatgen data_Ti2Al3Ru6W _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.29909483 _cell_length_b 6.06122327 _cell_length_c 12.87931671 _cell_angle_alpha 90.00007311 _cell_angle_beta 89.99881166 _cell_angle_gamma 89.99985486 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti2Al3Ru6W _chemical_formula_sum 'Ti4 Al6 Ru12 W2' _cell_volume 335.60631901 _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 Ti Ti0 1 0.99989613 0.50000972 0.33698211 1.0 Ti Ti1 1 0.50000026 0.99999249 0.50164532 1.0 Ti Ti2 1 0.00010717 0.50000819 0.66498798 1.0 Ti Ti3 1 0.50011298 0.99998897 0.82965650 1.0 Al Al4 1 0.00000541 0.99999488 0.99807741 1.0 Al Al5 1 0.49988962 0.50000257 0.16862106 1.0 Al Al6 1 0.99987020 0.99999791 0.33637475 1.0 Al Al7 1 0.50000021 0.50000238 0.50099529 1.0 Al Al8 1 0.00010227 0.99999769 0.66570822 1.0 Al Al9 1 0.50010960 0.50000311 0.83032804 1.0 Ru Ru10 1 0.49999812 0.25175409 0.00190776 1.0 Ru Ru11 1 0.50000051 0.74824450 0.00190776 1.0 Ru Ru12 1 0.99990392 0.24826139 0.16480642 1.0 Ru Ru13 1 0.99990110 0.75173720 0.16480633 1.0 Ru Ru14 1 0.49989728 0.24906010 0.33125509 1.0 Ru Ru15 1 0.49988389 0.75093974 0.33125391 1.0 Ru Ru16 1 0.99998284 0.25058436 0.49944138 1.0 Ru Ru17 1 0.00001753 0.74941630 0.49944101 1.0 Ru Ru18 1 0.50012503 0.24944478 0.66718554 1.0 Ru Ru19 1 0.50008476 0.75055576 0.66718597 1.0 Ru Ru20 1 0.00010477 0.25092716 0.83537729 1.0 Ru Ru21 1 0.00011828 0.74907229 0.83537783 1.0 W W22 1 0.99998179 0.50001082 0.99656647 1.0 W W23 1 0.49990731 0.99998859 0.17011156 1.0