data_[La8Ho4Se16]
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
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [4.0499]
_cell_length_b [14.2456]
_cell_length_c [14.1997]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [La2HoSe4]
_chemical_formula_sum '[La8 Ho4 Se16]'
_cell_volume [819.2272]
_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  8  0.0000  0.1301  0.0739  1.0
  Ho  Ho1  4  0.0000  0.3715  0.2500  1.0
  Se  Se2  8  0.0000  0.2182  0.6270  1.0
  Se  Se3  4  0.0000  0.0149  0.2500  1.0
  Se  Se4  4  0.0000  0.5000  0.0000  1.0
]