data_[Nd6Dy2Th4Sb12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Dy  1.2200  1.7500  1.1310
  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 [19.6141]
_cell_length_b [4.5021]
_cell_length_c [8.9892]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.4267]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Nd3Dy(ThSb3)2]
_chemical_formula_sum '[Nd6 Dy2 Th4 Sb12]'
_cell_volume [772.0907]
_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
[
  Nd  Nd0  4  0.1670  0.0000  0.8342  1
  Nd  Nd1  2  0.0000  0.5000  0.5000  1
  Dy  Dy2  2  0.0000  0.5000  0.0000  1
  Th  Th3  4  0.1648  0.0000  0.3307  1
  Sb  Sb4  4  0.0004  0.0000  0.7563  1
  Sb  Sb5  4  0.1641  0.5000  0.0824  1
  Sb  Sb6  4  0.1674  0.5000  0.5824  1
]