# generated using pymatgen data_LuTa(SiTc)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.35790580 _cell_length_b 6.96384448 _cell_length_c 12.06309408 _cell_angle_alpha 89.62300208 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural LuTa(SiTc)2 _chemical_formula_sum 'Lu3 Ta3 Si6 Tc6' _cell_volume 282.07648628 _cell_formula_units_Z 3 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 Lu Lu0 1 0.50000000 0.30258527 0.29916953 1.0 Lu Lu1 1 0.50000000 0.29518384 0.70085672 1.0 Lu Lu2 1 0.50000000 0.80457512 0.20165004 1.0 Ta Ta3 1 0.50000000 0.40138944 0.99482302 1.0 Ta Ta4 1 0.50000000 0.89802576 0.50625738 1.0 Ta Ta5 1 0.50000000 0.79536372 0.79976189 1.0 Si Si6 1 0.50000000 0.00342298 0.99827414 1.0 Si Si7 1 0.50000000 0.49944495 0.50020072 1.0 Si Si8 1 0.00000000 0.99018896 0.66862162 1.0 Si Si9 1 0.00000000 0.49978835 0.15626326 1.0 Si Si10 1 0.00000000 0.50242036 0.83369192 1.0 Si Si11 1 0.00000000 0.99760887 0.34388452 1.0 Tc Tc12 1 0.00000000 0.23754334 0.50365687 1.0 Tc Tc13 1 0.00000000 0.74276557 0.99162838 1.0 Tc Tc14 1 0.00000000 0.63262887 0.62938139 1.0 Tc Tc15 1 0.00000000 0.13794280 0.11888849 1.0 Tc Tc16 1 0.00000000 0.12259954 0.87231395 1.0 Tc Tc17 1 0.00000000 0.63672026 0.38067615 1.0