data_[Tb10Y10Sc4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Y  1.2200  1.8000  1.0400
  Sc  1.3600  1.6000  0.8850
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.8504]
_cell_length_b [5.5350]
_cell_length_c [11.8606]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.9055]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Tb5Y5Sc2]
_chemical_formula_sum '[Tb10 Y10 Sc4]'
_cell_volume [740.2851]
_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
[
  Tb  Tb0  4  0.0361  0.5000  0.2158  1.0
  Tb  Tb1  4  0.2061  0.5000  0.0475  1.0
  Tb  Tb2  2  0.0000  0.5000  0.5000  1.0
  Y  Y3  4  0.2003  0.0000  0.5456  1.0
  Y  Y4  4  0.2489  0.0000  0.2510  1.0
  Y  Y5  2  0.0000  0.0000  0.0000  1.0
  Sc  Sc6  4  0.0364  0.0000  0.7120  1.0
]