data_[Dy4Er14Th4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  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 [11.2276]
_cell_length_b [11.4504]
_cell_length_c [5.9627]
_cell_angle_alpha [90.0000]
_cell_angle_beta [113.6713]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Dy2Er7Th2]
_chemical_formula_sum '[Dy4 Er14 Th4]'
_cell_volume [702.0782]
_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
[
  Dy  Dy0  4  0.2361  0.0000  0.5867  1
  Er  Er1  8  0.1734  0.2335  0.1670  1
  Er  Er2  4  0.0919  0.5000  0.8062  1
  Er  Er3  2  0.0000  0.0000  0.0000  1
  Th  Th4  4  0.0000  0.2118  0.5000  1
]