# generated using pymatgen data_HfZr(SiTc)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.39458750 _cell_length_b 6.95215710 _cell_length_c 12.04439629 _cell_angle_alpha 90.02794418 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural HfZr(SiTc)2 _chemical_formula_sum 'Hf3 Zr3 Si6 Tc6' _cell_volume 284.24417323 _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 Hf Hf0 1 0.50000000 0.40204647 0.99952586 1.0 Hf Hf1 1 0.50000000 0.90217559 0.50026349 1.0 Hf Hf2 1 0.50000000 0.79904501 0.79879689 1.0 Zr Zr3 1 0.50000000 0.29889672 0.29817316 1.0 Zr Zr4 1 0.50000000 0.29809643 0.70194142 1.0 Zr Zr5 1 0.50000000 0.79875021 0.20168218 1.0 Si Si6 1 0.00000000 0.99819475 0.66661347 1.0 Si Si7 1 0.00000000 0.49970143 0.16533859 1.0 Si Si8 1 0.00000000 0.50140074 0.83390335 1.0 Si Si9 1 0.00000000 0.99969802 0.33445418 1.0 Si Si10 1 0.50000000 0.99985180 0.99953688 1.0 Si Si11 1 0.50000000 0.50026121 0.50036308 1.0 Tc Tc12 1 0.00000000 0.74498740 0.99882037 1.0 Tc Tc13 1 0.00000000 0.24512927 0.50035508 1.0 Tc Tc14 1 0.00000000 0.62881488 0.62742487 1.0 Tc Tc15 1 0.00000000 0.12805299 0.12591896 1.0 Tc Tc16 1 0.00000000 0.12687304 0.87296917 1.0 Tc Tc17 1 0.00000000 0.62822005 0.37391900 1.0