data_[Ce2Sm12Y4Ho6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Sm  1.1700  1.8500  1.2290
  Y  1.2200  1.8000  1.0400
  Ho  1.2300  1.7500  1.0410
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [6.2152]
_cell_length_b [10.7590]
_cell_length_c [11.8534]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.0381]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [CeSm6Y2Ho3]
_chemical_formula_sum '[Ce2 Sm12 Y4 Ho6]'
_cell_volume [780.4930]
_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
[
  Ce  Ce0  2  0.0000  0.0000  0.0000  1.0
  Sm  Sm1  8  0.2489  0.1656  0.2514  1.0
  Sm  Sm2  4  0.2477  0.0000  0.7486  1.0
  Y  Y3  4  0.0000  0.3334  0.0000  1.0
  Ho  Ho4  4  0.0000  0.1673  0.5000  1.0
  Ho  Ho5  2  0.0000  0.5000  0.5000  1.0
]