data_[Ho8Ga2Ge2S4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  Ga  1.8100  1.3000  0.7600
  Ge  2.0100  1.2500  0.7700
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [I-4m2]
_cell_length_a [5.6990]
_cell_length_b [5.6990]
_cell_length_c [11.3213]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [119]
_chemical_formula_structural [Ho4GaGeS2]
_chemical_formula_sum '[Ho8 Ga2 Ge2 S4]'
_cell_volume [367.7021]
_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
[
  Ho  Ho0  4  0.0000  0.0000  0.2422  1.0
  Ho  Ho1  4  0.0000  0.5000  0.0054  1.0
  Ga  Ga2  2  0.0000  0.0000  0.5000  1.0
  Ge  Ge3  2  0.0000  0.5000  0.7500  1.0
  S  S4  2  0.0000  0.0000  0.0000  1.0
  S  S5  2  0.0000  0.5000  0.2500  1.0
]