data_[Ce4Y2Th6Sb12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Y  1.2200  1.8000  1.0400
  Th  1.3000  1.8000  1.0800
  Sb  2.0500  1.4500  0.8300
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [19.5506]
_cell_length_b [4.4864]
_cell_length_c [8.9746]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.1908]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ce2Y(ThSb2)3]
_chemical_formula_sum '[Ce4 Y2 Th6 Sb12]'
_cell_volume [766.4105]
_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
[
  Ce  Ce0  4  0.1659  0.0000  0.3323  1
  Y  Y1  2  0.0000  0.5000  0.0000  1
  Th  Th2  4  0.1678  0.0000  0.8340  1
  Th  Th3  2  0.0000  0.5000  0.5000  1
  Sb  Sb4  4  0.0004  0.0000  0.7554  1
  Sb  Sb5  4  0.1640  0.5000  0.0830  1
  Sb  Sb6  4  0.1671  0.5000  0.5823  1
]