data_[Ho4Tm14Th4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  Tm  1.2500  1.7500  1.0950
  Th  1.3000  1.8000  1.0800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.1900]
_cell_length_b [11.4060]
_cell_length_c [5.9410]
_cell_angle_alpha [90.0000]
_cell_angle_beta [113.7764]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ho2Tm7Th2]
_chemical_formula_sum '[Ho4 Tm14 Th4]'
_cell_volume [693.9044]
_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  0.2372  0.0000  0.5857  1
  Tm  Tm1  8  0.1734  0.2334  0.1671  1
  Tm  Tm2  4  0.0930  0.5000  0.8068  1
  Tm  Tm3  2  0.0000  0.0000  0.0000  1
  Th  Th4  4  0.0000  0.2113  0.5000  1
]