# generated using pymatgen data_Hf2Ta(SiTc)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.87280478 _cell_length_b 6.92833778 _cell_length_c 3.33573155 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.26767117 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf2Ta(SiTc)3 _chemical_formula_sum 'Hf2 Ta1 Si3 Tc3' _cell_volume 137.18513726 _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 Hf Hf0 1 0.40101806 0.40304704 0.50000000 1.0 Hf Hf1 1 0.59898194 0.00202898 0.50000000 1.0 Ta Ta2 1 0.00000000 0.59808264 0.50000000 1.0 Si Si3 1 0.67252748 0.33835505 0.00000000 1.0 Si Si4 1 0.32747252 0.66582857 0.00000000 1.0 Si Si5 1 1.00000000 0.99719149 0.50000000 1.0 Tc Tc6 1 0.74748163 0.74429833 0.00000000 1.0 Tc Tc7 1 0.25251837 0.99681670 0.00000000 1.0 Tc Tc8 1 1.00000000 0.25434919 0.00000000 1.0