data_[Li4Ho4Si8S24]
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
  Si  1.9000  1.1000  0.5400
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [12.2855]
_cell_length_b [11.5430]
_cell_length_c [6.3325]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.9526]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [LiHo(SiS3)2]
_chemical_formula_sum '[Li4 Ho4 Si8 S24]'
_cell_volume [871.5156]
_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  0.2921  0.2500  1.0
  Ho  Ho1  4  0.0000  0.1169  0.7500  1.0
  Si  Si2  8  0.2027  0.4195  0.7728  1.0
  S  S3  8  0.1178  0.0844  0.1658  1.0
  S  S4  8  0.1335  0.2667  0.6164  1.0
  S  S5  8  0.1405  0.4324  0.0662  1.0
]