data_[Ce8Dy2Ir8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Dy  1.2200  1.7500  1.1310
  Ir  2.2000  1.3500  0.7650
]
_symmetry_space_group_name_H-M [P4_2/n]
_cell_length_a [8.9330]
_cell_length_b [8.9330]
_cell_length_c [5.6698]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [86]
_chemical_formula_structural [Ce4DyIr4]
_chemical_formula_sum '[Ce8 Dy2 Ir8]'
_cell_volume [452.4464]
_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
[
  Ce  Ce0  8  0.0934  0.6866  0.4394  1.0
  Dy  Dy1  2  0.0000  0.0000  0.0000  1.0
  Ir  Ir2  8  0.1198  0.7080  0.9363  1.0
]