data_[Li2Nd8Ho8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Nd  1.1400  1.8500  1.2765
  Ho  1.2300  1.7500  1.0410
]
_symmetry_space_group_name_H-M [I222]
_cell_length_a [6.3310]
_cell_length_b [7.9191]
_cell_length_c [11.5293]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [23]
_chemical_formula_structural [Li(NdHo)4]
_chemical_formula_sum '[Li2 Nd8 Ho8]'
_cell_volume [578.0315]
_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
[
  Li  Li0  2  0.0000  0.0000  0.0000  1
  Nd  Nd1  4  0.0000  0.3200  0.0000  1
  Nd  Nd2  2  0.0000  0.0000  0.5000  1
  Nd  Nd3  2  0.0000  0.5000  0.5000  1
  Ho  Ho4  8  0.2374  0.1367  0.7551  1
]