data_[La12Ho4Th2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Ho  1.2300  1.7500  1.0410
  Th  1.3000  1.8000  1.0800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [9.4299]
_cell_length_b [18.2620]
_cell_length_c [3.6885]
_cell_angle_alpha [90.0000]
_cell_angle_beta [99.4983]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [La6Ho2Th]
_chemical_formula_sum '[La12 Ho4 Th2]'
_cell_volume [626.4816]
_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  8  0.1707  0.3277  0.8201  1
  La  La1  4  0.1766  0.5000  0.3235  1
  Ho  Ho2  4  0.0000  0.1603  0.5000  1
  Th  Th3  2  0.0000  0.0000  0.0000  1
]