data_[Tb4Ho10Th6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Ho  1.2300  1.7500  1.0410
  Th  1.3000  1.8000  1.0800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.2011]
_cell_length_b [5.0238]
_cell_length_c [11.2563]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.4464]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Tb2Ho5Th3]
_chemical_formula_sum '[Tb4 Ho10 Th6]'
_cell_volume [633.4025]
_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  0.0975  0.5000  0.7985  1
  Ho  Ho1  4  0.1998  0.5000  0.1014  1
  Ho  Ho2  4  0.2001  0.0000  0.5994  1
  Ho  Ho3  2  0.0000  0.0000  0.0000  1
  Th  Th4  4  0.0987  0.0000  0.2997  1
  Th  Th5  2  0.0000  0.5000  0.5000  1
]