data_[Li4Nd8Ho4Se20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Nd  1.1400  1.8500  1.2765
  Ho  1.2300  1.7500  1.0410
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [4.1360]
_cell_length_b [17.2787]
_cell_length_c [12.4423]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [LiNd2HoSe5]
_chemical_formula_sum '[Li4 Nd8 Ho4 Se20]'
_cell_volume [889.1793]
_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
[
  Li  Li0  4  0.0000  0.4861  0.4814  1.0
  Nd  Nd1  4  0.0000  0.1075  0.6855  1.0
  Nd  Nd2  4  0.0000  0.1255  0.2967  1.0
  Ho  Ho3  4  0.0000  0.1969  0.0027  1.0
  Se  Se4  4  0.0000  0.0474  0.0715  1.0
  Se  Se5  4  0.0000  0.2852  0.6603  1.0
  Se  Se6  4  0.0000  0.3077  0.3441  1.0
  Se  Se7  4  0.0000  0.3619  0.9978  1.0
  Se  Se8  4  0.0000  0.4997  0.2841  1.0
]