# generated using pymatgen data_HfSi2MoIr2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.95293983 _cell_length_b 6.25921056 _cell_length_c 7.24011503 _cell_angle_alpha 90.64652470 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural HfSi2MoIr2 _chemical_formula_sum 'Hf2 Si4 Mo2 Ir4' _cell_volume 179.12556840 _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 0.02961208 0.30982054 1.0 Hf Hf1 1 0.75000000 0.97038792 0.69017946 1.0 Si Si2 1 0.25000000 0.74595385 0.89201286 1.0 Si Si3 1 0.75000000 0.25404615 0.10798714 1.0 Si Si4 1 0.25000000 0.29475194 0.63548095 1.0 Si Si5 1 0.75000000 0.70524806 0.36451905 1.0 Mo Mo6 1 0.25000000 0.52134469 0.17108365 1.0 Mo Mo7 1 0.75000000 0.47865531 0.82891635 1.0 Ir Ir8 1 0.75000000 0.85586474 0.06822060 1.0 Ir Ir9 1 0.25000000 0.14413526 0.93177940 1.0 Ir Ir10 1 0.75000000 0.33558274 0.44656365 1.0 Ir Ir11 1 0.25000000 0.66441726 0.55343635 1.0