data_[Ho6Er8Th2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  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 [23.1683]
_cell_length_b [3.4300]
_cell_length_c [6.6505]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.6262]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ho3Er4Th]
_chemical_formula_sum '[Ho6 Er8 Th2]'
_cell_volume [506.4042]
_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
[
  Ho  Ho0  4  0.1245  0.0000  0.3654  1
  Ho  Ho1  2  0.0000  0.0000  0.5000  1
  Er  Er2  4  0.1246  0.0000  0.8838  1
  Er  Er3  4  0.2409  0.5000  0.2400  1
  Th  Th4  2  0.0000  0.5000  0.0000  1
]