data_[Tb6Pr2Y2Sc2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Pr  1.1300  1.8500  1.0600
  Y  1.2200  1.8000  1.0400
  Sc  1.3600  1.6000  0.8850
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [9.3091]
_cell_length_b [3.6677]
_cell_length_c [11.6471]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.1359]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Tb3PrYSc]
_chemical_formula_sum '[Tb6 Pr2 Y2 Sc2]'
_cell_volume [380.0148]
_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  0.1613  0.2500  0.0537  1.0
  Tb  Tb1  2  0.1764  0.2500  0.5532  1.0
  Tb  Tb2  2  0.2366  0.7500  0.8192  1.0
  Pr  Pr3  2  0.4538  0.2500  0.3512  1.0
  Y  Y4  2  0.0941  0.7500  0.2856  1.0
  Sc  Sc5  2  0.4590  0.7500  0.0992  1.0
]