# generated using pymatgen data_HfTc(PRu)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.86287031 _cell_length_b 6.14364477 _cell_length_c 7.05014526 _cell_angle_alpha 89.94532526 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural HfTc(PRu)2 _chemical_formula_sum 'Hf2 Tc2 P4 Ru4' _cell_volume 167.31469711 _cell_formula_units_Z 2 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 0.02816991 0.81742150 1.0 Hf Hf1 1 0.75000000 0.97183009 0.18257850 1.0 Tc Tc2 1 0.25000000 0.52490777 0.66153308 1.0 Tc Tc3 1 0.75000000 0.47509223 0.33846692 1.0 P P4 1 0.25000000 0.27736737 0.12770487 1.0 P P5 1 0.75000000 0.72263263 0.87229513 1.0 P P6 1 0.25000000 0.75117264 0.39049151 1.0 P P7 1 0.75000000 0.24882736 0.60950849 1.0 Ru Ru8 1 0.75000000 0.85119586 0.56485290 1.0 Ru Ru9 1 0.25000000 0.14880414 0.43514710 1.0 Ru Ru10 1 0.75000000 0.35361262 0.93733718 1.0 Ru Ru11 1 0.25000000 0.64638738 0.06266282 1.0