data_[Th2Rh2O6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Th  1.3000  1.8000  1.0800
  Rh  2.2800  1.3500  0.7450
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [3.7089]
_cell_length_b [7.0048]
_cell_length_c [5.3017]
_cell_angle_alpha [90.0000]
_cell_angle_beta [92.0120]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [ThRhO3]
_chemical_formula_sum '[Th2 Rh2 O6]'
_cell_volume [137.6545]
_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
[
  Th  Th0  2  0.2745  0.2500  0.4923  1
  Rh  Rh1  2  0.0000  0.0000  0.0000  1
  O  O2  4  0.2511  0.5603  0.6735  1
  O  O3  2  0.1610  0.7500  0.1729  1
]