data_[Cs2Ho2Ge2S8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Ho  1.2300  1.7500  1.0410
  Ge  2.0100  1.2500  0.7700
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [6.4941]
_cell_length_b [6.8246]
_cell_length_c [9.4995]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.2256]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [CsHoGeS4]
_chemical_formula_sum '[Cs2 Ho2 Ge2 S8]'
_cell_volume [399.8902]
_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
[
  Cs  Cs0  2  0.2624  0.2500  0.0608  1.0
  Ho  Ho1  2  0.2208  0.2500  0.5460  1.0
  Ge  Ge2  2  0.2284  0.7500  0.3428  1.0
  S  S3  4  0.0055  0.5017  0.6901  1.0
  S  S4  2  0.4291  0.7500  0.1936  1.0
  S  S5  2  0.4467  0.7500  0.5734  1.0
]