# generated using pymatgen data_Hf4FeSi4Ir3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.92992058 _cell_length_b 6.42173759 _cell_length_c 7.33048551 _cell_angle_alpha 89.84417130 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf4FeSi4Ir3 _chemical_formula_sum 'Hf4 Fe1 Si4 Ir3' _cell_volume 184.99818276 _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 0.01805703 0.31667542 1.0 Hf Hf1 1 0.25000000 0.51488326 0.18788547 1.0 Hf Hf2 1 0.75000000 0.99055826 0.68055970 1.0 Hf Hf3 1 0.75000000 0.47794558 0.81673440 1.0 Fe Fe4 1 0.75000000 0.34481673 0.43680627 1.0 Si Si5 1 0.25000000 0.28032922 0.60834797 1.0 Si Si6 1 0.25000000 0.77897248 0.87928936 1.0 Si Si7 1 0.75000000 0.71618229 0.38332834 1.0 Si Si8 1 0.75000000 0.22445040 0.12832913 1.0 Ir Ir9 1 0.25000000 0.15705640 0.93307089 1.0 Ir Ir10 1 0.25000000 0.65399127 0.56421221 1.0 Ir Ir11 1 0.75000000 0.84275807 0.06475984 1.0