data_[Na2Ac2Ho2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Ac  1.1000  1.9500  1.2600
  Ho  1.2300  1.7500  1.0410
]
_symmetry_space_group_name_H-M [I4mm]
_cell_length_a [3.7304]
_cell_length_b [3.7304]
_cell_length_c [16.4203]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [107]
_chemical_formula_structural [NaAcHo]
_chemical_formula_sum '[Na2 Ac2 Ho2]'
_cell_volume [228.5077]
_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
[
  Na  Na0  2  0.0000  0.0000  0.0066  1
  Ac  Ac1  2  0.0000  0.0000  0.3244  1
  Ho  Ho2  2  0.0000  0.0000  0.6690  1
]