data_[La4Y4Ho12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  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 [18.3244]
_cell_length_b [5.0320]
_cell_length_c [7.2010]
_cell_angle_alpha [90.0000]
_cell_angle_beta [101.1684]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [LaYHo3]
_chemical_formula_sum '[La4 Y4 Ho12]'
_cell_volume [651.4225]
_cell_formula_units_Z [4]
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  4  0.1983  0.0000  0.3457  1.0
  Y  Y1  4  0.0970  0.5000  0.5484  1.0
  Ho  Ho2  4  0.0023  0.0000  0.7536  1.0
  Ho  Ho3  4  0.0986  0.5000  0.0460  1.0
  Ho  Ho4  4  0.1983  0.0000  0.8500  1.0
]