data_[Tb4Y2Th5]
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
  Th  1.3000  1.8000  1.0800
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [8.8360]
_cell_length_b [3.4706]
_cell_length_c [11.6919]
_cell_angle_alpha [90.0000]
_cell_angle_beta [94.6261]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [Tb4Y2Th5]
_chemical_formula_sum '[Tb4 Y2 Th5]'
_cell_volume [357.3758]
_cell_formula_units_Z [1]
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  0.1596  0.5000  0.9014  1
  Tb  Tb1  2  0.2959  0.5000  0.4459  1
  Y  Y2  2  0.0572  0.0000  0.6366  1
  Th  Th3  2  0.2054  0.0000  0.1739  1
  Th  Th4  2  0.4279  0.0000  0.7112  1
  Th  Th5  1  0.5000  0.0000  0.0000  1
]