data_[Li6Ho2Cl12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Ho  1.2300  1.7500  1.0410
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [6.5936]
_cell_length_b [6.6580]
_cell_length_c [12.1893]
_cell_angle_alpha [90.0000]
_cell_angle_beta [122.7809]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Li3HoCl6]
_chemical_formula_sum '[Li6 Ho2 Cl12]'
_cell_volume [449.8892]
_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  4  0.2537  0.5174  0.2681  1.0
  Li  Li1  2  0.5000  0.0000  0.5000  1.0
  Ho  Ho2  2  0.0000  0.0000  0.0000  1.0
  Cl  Cl3  4  0.0957  0.6122  0.7330  1.0
  Cl  Cl4  4  0.2562  0.1706  0.5945  1.0
  Cl  Cl5  4  0.4019  0.6805  0.5588  1.0
]