data_[Ce8Ag8Ge16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Ag  1.9300  1.6000  1.0867
  Ge  2.0100  1.2500  0.7700
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [14.0357]
_cell_length_b [4.3244]
_cell_length_c [11.2723]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [CeAgGe2]
_chemical_formula_sum '[Ce8 Ag8 Ge16]'
_cell_volume [684.1864]
_cell_formula_units_Z [8]
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  4  0.0455  0.2500  0.7552  1
  Ce  Ce1  4  0.2022  0.7500  0.0453  1
  Ag  Ag2  4  0.0595  0.2500  0.4552  1
  Ag  Ag3  4  0.2061  0.7500  0.3389  1
  Ge  Ge4  4  0.0417  0.2500  0.0257  1
  Ge  Ge5  4  0.1132  0.2500  0.2299  1
  Ge  Ge6  4  0.1342  0.7500  0.5575  1
  Ge  Ge7  4  0.1996  0.7500  0.7629  1
]