data_[Na4Li4Ho8S16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Li  0.9800  1.4500  0.9000
  Ho  1.2300  1.7500  1.0410
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [Imma]
_cell_length_a [7.8376]
_cell_length_b [7.9086]
_cell_length_c [11.1405]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [74]
_chemical_formula_structural [NaLi(HoS2)2]
_chemical_formula_sum '[Na4 Li4 Ho8 S16]'
_cell_volume [690.5475]
_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
[
  Na  Na0  4  0.2500  0.2500  0.7500  1.0
  Li  Li1  4  0.0000  0.0000  0.5000  1.0
  Ho  Ho2  4  0.0000  0.0000  0.0000  1.0
  Ho  Ho3  4  0.2500  0.2500  0.2500  1.0
  S  S4  8  0.0000  0.0117  0.2464  1.0
  S  S5  8  0.2444  0.2500  0.0054  1.0
]