data_[Ce16In4Ge4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  In  1.7800  1.5500  0.9400
  Ge  2.0100  1.2500  0.7700
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [8.9948]
_cell_length_b [12.7646]
_cell_length_c [5.6847]
_cell_angle_alpha [90.0000]
_cell_angle_beta [110.6129]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Ce4InGe]
_chemical_formula_sum '[Ce16 In4 Ge4]'
_cell_volume [610.9064]
_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
[
  Ce  Ce0  8  0.1231  0.1929  0.6630  1.0
  Ce  Ce1  8  0.2153  0.3953  0.8684  1.0
  In  In2  4  0.0000  0.3842  0.2500  1.0
  Ge  Ge3  4  0.0000  0.0203  0.2500  1.0
]