# generated using pymatgen data_Sc2Be2FeIr5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.43805486 _cell_length_b 9.43805486 _cell_length_c 3.07725147 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc2Be2FeIr5 _chemical_formula_sum 'Sc4 Be4 Fe2 Ir10' _cell_volume 274.11195836 _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 Sc Sc0 1 0.17603884 0.67603884 0.00000000 1.0 Sc Sc1 1 0.82396116 0.32396116 0.00000000 1.0 Sc Sc2 1 0.32396116 0.17603884 0.00000000 1.0 Sc Sc3 1 0.67603884 0.82396116 0.00000000 1.0 Be Be4 1 0.37554819 0.87554819 0.00000000 1.0 Be Be5 1 0.87554819 0.62445181 0.00000000 1.0 Be Be6 1 0.12445181 0.37554819 0.00000000 1.0 Be Be7 1 0.62445181 0.12445181 0.00000000 1.0 Fe Fe8 1 0.00000000 0.00000000 0.00000000 1.0 Fe Fe9 1 0.50000000 0.50000000 0.00000000 1.0 Ir Ir10 1 0.50000000 0.00000000 0.50000000 1.0 Ir Ir11 1 0.70893858 0.56816068 0.50000000 1.0 Ir Ir12 1 0.56816068 0.29106142 0.50000000 1.0 Ir Ir13 1 0.43183932 0.70893858 0.50000000 1.0 Ir Ir14 1 0.29106142 0.43183932 0.50000000 1.0 Ir Ir15 1 0.00000000 0.50000000 0.50000000 1.0 Ir Ir16 1 0.93183932 0.79106142 0.50000000 1.0 Ir Ir17 1 0.79106142 0.06816068 0.50000000 1.0 Ir Ir18 1 0.20893858 0.93183932 0.50000000 1.0 Ir Ir19 1 0.06816068 0.20893858 0.50000000 1.0