data_[Li2Sm2Ho2Se6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Sm  1.1700  1.8500  1.2290
  Ho  1.2300  1.7500  1.0410
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [8.3659]
_cell_length_b [3.9922]
_cell_length_c [8.7915]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.9237]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [LiSmHoSe3]
_chemical_formula_sum '[Li2 Sm2 Ho2 Se6]'
_cell_volume [286.1822]
_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
[
  Li  Li0  2  0.0862  0.2500  0.5842  1.0
  Sm  Sm1  2  0.1889  0.2500  0.2254  1.0
  Ho  Ho2  2  0.3333  0.7500  0.8350  1.0
  Se  Se3  2  0.0936  0.2500  0.8707  1.0
  Se  Se4  2  0.2228  0.7500  0.4978  1.0
  Se  Se5  2  0.4297  0.7500  0.1724  1.0
]