data_[La6Dy12Er4Th2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Dy  1.2200  1.7500  1.1310
  Er  1.2400  1.7500  1.0300
  Th  1.3000  1.8000  1.0800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [6.2154]
_cell_length_b [10.7643]
_cell_length_c [11.8836]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.0562]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [La3Dy6Er2Th]
_chemical_formula_sum '[La6 Dy12 Er4 Th2]'
_cell_volume [782.8514]
_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
[
  La  La0  4  0.0000  0.1670  0.5000  1
  La  La1  2  0.0000  0.5000  0.5000  1
  Dy  Dy2  8  0.2465  0.1653  0.2438  1
  Dy  Dy3  4  0.2492  0.0000  0.7559  1
  Er  Er4  4  0.0000  0.3332  0.0000  1
  Th  Th5  2  0.0000  0.0000  0.0000  1
]