data_[La20Sm8Ho4Sc4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Sm  1.1700  1.8500  1.2290
  Ho  1.2300  1.7500  1.0410
  Sc  1.3600  1.6000  0.8850
]
_symmetry_space_group_name_H-M [I4/mcm]
_cell_length_a [8.4422]
_cell_length_b [8.4422]
_cell_length_c [17.7150]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [140]
_chemical_formula_structural [La5Sm2HoSc]
_chemical_formula_sum '[La20 Sm8 Ho4 Sc4]'
_cell_volume [1262.5740]
_cell_formula_units_Z [4]
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
[
  La  La0  16  0.2195  0.2805  0.3556  1
  La  La1  4  0.0000  0.0000  0.0000  1
  Sm  Sm2  8  0.1269  0.3731  0.0000  1
  Ho  Ho3  4  0.0000  0.0000  0.2500  1
  Sc  Sc4  4  0.0000  0.5000  0.2500  1
]