# generated using pymatgen data_Hf4Ti3TcP4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.50653145 _cell_length_b 6.67803775 _cell_length_c 8.05799742 _cell_angle_alpha 90.01980826 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf4Ti3TcP4 _chemical_formula_sum 'Hf4 Ti3 Tc1 P4' _cell_volume 188.69209500 _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 0.25000000 0.53364831 0.16702074 1.0 Hf Hf1 1 0.75000000 0.46039155 0.83213810 1.0 Hf Hf2 1 0.75000000 0.96593931 0.66968242 1.0 Hf Hf3 1 0.25000000 0.03664691 0.32722368 1.0 Ti Ti4 1 0.25000000 0.63489466 0.56206670 1.0 Ti Ti5 1 0.75000000 0.36110957 0.44117175 1.0 Ti Ti6 1 0.75000000 0.86865071 0.05756747 1.0 Tc Tc7 1 0.25000000 0.13741280 0.93954041 1.0 P P8 1 0.25000000 0.76084484 0.85889124 1.0 P P9 1 0.75000000 0.24084683 0.14355637 1.0 P P10 1 0.75000000 0.73830525 0.36082976 1.0 P P11 1 0.25000000 0.26130826 0.64030936 1.0