# generated using pymatgen data_LuHf2(TcP)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.78443165 _cell_length_b 6.75716366 _cell_length_c 3.48260183 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.86714182 _symmetry_Int_Tables_number 1 _chemical_formula_structural LuHf2(TcP)3 _chemical_formula_sum 'Lu1 Hf2 Tc3 P3' _cell_volume 138.44976661 _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 Lu Lu0 1 0.00000000 0.59503303 0.50000000 1.0 Hf Hf1 1 0.40538448 0.40331335 0.50000000 1.0 Hf Hf2 1 0.59461552 0.99792887 0.50000000 1.0 Tc Tc3 1 0.24957339 0.00501664 0.00000000 1.0 Tc Tc4 1 0.75042661 0.75544325 0.00000000 1.0 Tc Tc5 1 1.00000000 0.24344444 0.00000000 1.0 P P6 1 0.66224040 0.32939700 0.00000000 1.0 P P7 1 0.33775960 0.66715759 0.00000000 1.0 P P8 1 0.00000000 0.00326584 0.50000000 1.0