# generated using pymatgen data_Hf4SiP3Ir4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.82895945 _cell_length_b 6.46159800 _cell_length_c 7.36526053 _cell_angle_alpha 89.68911036 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf4SiP3Ir4 _chemical_formula_sum 'Hf4 Si1 P3 Ir4' _cell_volume 182.22267741 _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 0.52389440 0.17510245 1.0 Hf Hf1 1 0.75000000 0.47562201 0.82293083 1.0 Hf Hf2 1 0.25000000 0.02711368 0.32245958 1.0 Hf Hf3 1 0.75000000 0.97550903 0.67950660 1.0 Si Si4 1 0.75000000 0.73347855 0.37905621 1.0 P P5 1 0.25000000 0.75995234 0.87673676 1.0 P P6 1 0.75000000 0.23897172 0.12311273 1.0 P P7 1 0.25000000 0.26371978 0.62177300 1.0 Ir Ir8 1 0.75000000 0.85400741 0.06475196 1.0 Ir Ir9 1 0.25000000 0.14848406 0.93328586 1.0 Ir Ir10 1 0.75000000 0.35282002 0.43639715 1.0 Ir Ir11 1 0.25000000 0.64642700 0.56488687 1.0