data_[Ce2Hf8Ge8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Hf  1.3000  1.5500  0.8500
  Ge  2.0100  1.2500  0.7700
]
_symmetry_space_group_name_H-M [P4_2/n]
_cell_length_a [8.9077]
_cell_length_b [8.9077]
_cell_length_c [5.3110]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [86]
_chemical_formula_structural [Ce(HfGe)4]
_chemical_formula_sum '[Ce2 Hf8 Ge8]'
_cell_volume [421.4092]
_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
[
  Ce  Ce0  2  0.0000  0.0000  0.0000  1
  Hf  Hf1  8  0.1152  0.3649  0.6062  1
  Ge  Ge2  8  0.1560  0.3078  0.0940  1
]