# generated using pymatgen data_Ti19Si16W _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.66721730 _cell_length_b 6.66721792 _cell_length_c 12.16742996 _cell_angle_alpha 90.01686900 _cell_angle_beta 89.98312720 _cell_angle_gamma 90.02649515 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti19Si16W _chemical_formula_sum 'Ti19 Si16 W1' _cell_volume 540.86394445 _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 Ti Ti0 1 0.99573537 0.14895282 0.62244245 1.0 Ti Ti1 1 0.34957587 0.49538261 0.87191059 1.0 Ti Ti2 1 0.64993129 0.50404405 0.37170198 1.0 Ti Ti3 1 0.49538261 0.34957587 0.12808941 1.0 Ti Ti4 1 0.50404405 0.64993129 0.62829802 1.0 Ti Ti5 1 0.00563228 0.85119906 0.12137749 1.0 Ti Ti6 1 0.14895282 0.99573537 0.37755755 1.0 Ti Ti7 1 0.85119906 0.00563228 0.87862251 1.0 Ti Ti8 1 0.00469855 0.34416133 0.21842644 1.0 Ti Ti9 1 0.15521208 0.50284533 0.46862463 1.0 Ti Ti10 1 0.84376925 0.49629378 0.96895866 1.0 Ti Ti11 1 0.50284533 0.15521208 0.53137537 1.0 Ti Ti12 1 0.49629378 0.84376925 0.03104134 1.0 Ti Ti13 1 0.99700674 0.65704188 0.71920138 1.0 Ti Ti14 1 0.34416133 0.00469855 0.78157356 1.0 Ti Ti15 1 0.65704188 0.99700674 0.28079862 1.0 Ti Ti16 1 0.32886069 0.67041772 0.24932003 1.0 Ti Ti17 1 0.67041772 0.32886069 0.75067997 1.0 Ti Ti18 1 0.82873539 0.82873539 0.50000000 1.0 Si Si19 1 0.04472081 0.30140699 0.81267116 1.0 Si Si20 1 0.19946613 0.54453131 0.06347124 1.0 Si Si21 1 0.80078541 0.45470427 0.56337388 1.0 Si Si22 1 0.54453131 0.19946613 0.93652876 1.0 Si Si23 1 0.45470427 0.80078541 0.43662612 1.0 Si Si24 1 0.95509869 0.69853106 0.31322486 1.0 Si Si25 1 0.30140699 0.04472081 0.18732884 1.0 Si Si26 1 0.69853106 0.95509869 0.68677514 1.0 Si Si27 1 0.29460521 0.35805198 0.67309396 1.0 Si Si28 1 0.14137468 0.79403887 0.92238584 1.0 Si Si29 1 0.85786379 0.20565833 0.42352771 1.0 Si Si30 1 0.79403887 0.14137468 0.07761416 1.0 Si Si31 1 0.20565833 0.85786379 0.57647229 1.0 Si Si32 1 0.70567642 0.64234560 0.17319021 1.0 Si Si33 1 0.35805198 0.29460521 0.32690604 1.0 Si Si34 1 0.64234560 0.70567642 0.82680979 1.0 W W35 1 0.17164337 0.17164337 1.00000000 1.0