data_[Tb3Y6Sc3O18]
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
  Sc  1.3600  1.6000  0.8850
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [R3]
_cell_length_a [5.7234]
_cell_length_b [5.7234]
_cell_length_c [14.9755]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [146]
_chemical_formula_structural [TbY2ScO6]
_chemical_formula_sum '[Tb3 Y6 Sc3 O18]'
_cell_volume [424.8411]
_cell_formula_units_Z [3]
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  3  0.0000  0.0000  0.1933  1
  Y  Y1  3  0.0000  0.0000  0.4722  1
  Y  Y2  3  0.0000  0.0000  0.9753  1
  Sc  Sc3  3  0.0000  0.0000  0.6872  1
  O  O4  9  0.0436  0.3513  0.7500  1
  O  O5  9  0.0511  0.6725  0.2535  1
]