# generated using pymatgen data_Hf3Tc(PRu)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.83048826 _cell_length_b 6.27923579 _cell_length_c 7.18483271 _cell_angle_alpha 89.33841325 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf3Tc(PRu)4 _chemical_formula_sum 'Hf3 Tc1 P4 Ru4' _cell_volume 172.80194840 _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 0.02933910 0.17875055 1.0 Hf Hf1 1 0.25000000 0.52288574 0.32989631 1.0 Hf Hf2 1 0.75000000 0.97656234 0.81441120 1.0 Tc Tc3 1 0.75000000 0.46997774 0.67515663 1.0 P P4 1 0.25000000 0.76135545 0.62664385 1.0 P P5 1 0.25000000 0.28782644 0.86173303 1.0 P P6 1 0.75000000 0.23069279 0.39101284 1.0 P P7 1 0.75000000 0.72840656 0.12320680 1.0 Ru Ru8 1 0.25000000 0.14390996 0.56404539 1.0 Ru Ru9 1 0.25000000 0.65046937 0.93929448 1.0 Ru Ru10 1 0.75000000 0.84956079 0.43786532 1.0 Ru Ru11 1 0.75000000 0.34901475 0.05798361 1.0