data_[Li8Ho32Ir16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Ho  1.2300  1.7500  1.0410
  Ir  2.2000  1.3500  0.7650
]
_symmetry_space_group_name_H-M [Fdd2]
_cell_length_a [10.4230]
_cell_length_b [14.6017]
_cell_length_c [8.8650]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [43]
_chemical_formula_structural [Li(Ho2Ir)2]
_chemical_formula_sum '[Li8 Ho32 Ir16]'
_cell_volume [1349.1837]
_cell_formula_units_Z [8]
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
[
  Li  Li0  8  0.0000  0.0000  0.7304  1.0
  Ho  Ho1  16  0.0214  0.3830  0.9186  1.0
  Ho  Ho2  16  0.1126  0.3297  0.3469  1.0
  Ir  Ir3  16  0.0370  0.2673  0.6371  1.0
]