data_[Tb2Y4Sc2]
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 [Cm]
_cell_length_a [12.7254]
_cell_length_b [3.5771]
_cell_length_c [6.1644]
_cell_angle_alpha [90.0000]
_cell_angle_beta [118.9448]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [TbY2Sc]
_chemical_formula_sum '[Tb2 Y4 Sc2]'
_cell_volume [245.5509]
_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  2  0.3689  0.0000  0.8153  1.0
  Y  Y1  2  0.1248  0.0000  0.9133  1.0
  Y  Y2  2  0.3817  0.5000  0.3278  1.0
  Sc  Sc3  2  0.1261  0.5000  0.4075  1.0
]