data_[Y12Ho6Th2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  Ho  1.2300  1.7500  1.0410
  Th  1.3000  1.8000  1.0800
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [9.9574]
_cell_length_b [6.3445]
_cell_length_c [11.8784]
_cell_angle_alpha [90.0000]
_cell_angle_beta [118.9171]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Y6Ho3Th]
_chemical_formula_sum '[Y12 Ho6 Th2]'
_cell_volume [656.8567]
_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
[
  Y  Y0  4  0.1276  0.7140  0.2854  1
  Y  Y1  4  0.1874  0.5048  0.0411  1
  Y  Y2  4  0.4237  0.0037  0.1266  1
  Ho  Ho3  4  0.2358  0.2208  0.2866  1
  Ho  Ho4  2  0.5000  0.0000  0.5000  1
  Th  Th5  2  0.0000  0.0000  0.0000  1
]