data_[Tb10Pr4Y10]
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
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [17.1455]
_cell_length_b [5.7029]
_cell_length_c [9.7061]
_cell_angle_alpha [90.0000]
_cell_angle_beta [124.3702]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Tb5Pr2Y5]
_chemical_formula_sum '[Tb10 Pr4 Y10]'
_cell_volume [783.3523]
_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  0.1232  0.5000  0.2829  1.0
  Tb  Tb1  4  0.1245  0.5000  0.9512  1.0
  Tb  Tb2  2  0.0000  0.5000  0.5000  1.0
  Pr  Pr3  4  0.1286  0.0000  0.8071  1.0
  Y  Y4  4  0.1239  0.0000  0.4647  1.0
  Y  Y5  4  0.2500  0.5000  0.7377  1.0
  Y  Y6  2  0.0000  0.0000  0.0000  1.0
]