# generated using pymatgen data_Si5Ir4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.65278700 _cell_length_b 5.94335235 _cell_length_c 12.45142482 _cell_angle_alpha 100.03414556 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Si5Ir4 _chemical_formula_sum 'Si10 Ir8' _cell_volume 266.18318688 _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 Si Si0 1 0.25000000 0.64283800 0.63708000 1.0 Si Si1 1 0.75000000 0.35716200 0.36292000 1.0 Si Si2 1 0.25000000 0.89046200 0.42415300 1.0 Si Si3 1 0.75000000 0.10953800 0.57584700 1.0 Si Si4 1 0.25000000 0.47220200 0.22462200 1.0 Si Si5 1 0.75000000 0.52779800 0.77537800 1.0 Si Si6 1 0.75000000 0.97829700 0.14099000 1.0 Si Si7 1 0.25000000 0.02170300 0.85901000 1.0 Si Si8 1 0.25000000 0.49130700 0.92161300 1.0 Si Si9 1 0.75000000 0.50869300 0.07838700 1.0 Ir Ir10 1 0.25000000 0.21876600 0.04926800 1.0 Ir Ir11 1 0.75000000 0.78123400 0.95073200 1.0 Ir Ir12 1 0.25000000 0.10746000 0.27365700 1.0 Ir Ir13 1 0.75000000 0.89254000 0.72634300 1.0 Ir Ir14 1 0.25000000 0.30017900 0.50153800 1.0 Ir Ir15 1 0.75000000 0.69982100 0.49846200 1.0 Ir Ir16 1 0.25000000 0.28983500 0.73121300 1.0 Ir Ir17 1 0.75000000 0.71016500 0.26878700 1.0