data_[Ce6Ga6Ge4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Ga  1.8100  1.3000  0.7600
  Ge  2.0100  1.2500  0.7700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [16.2430]
_cell_length_b [4.1339]
_cell_length_c [5.5104]
_cell_angle_alpha [90.0000]
_cell_angle_beta [95.2727]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ce3Ga3Ge2]
_chemical_formula_sum '[Ce6 Ga6 Ge4]'
_cell_volume [368.4407]
_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  4  0.1509  0.0000  0.6322  1
  Ce  Ce1  2  0.0000  0.0000  0.0000  1
  Ga  Ga2  4  0.1294  0.5000  0.1745  1
  Ga  Ga3  2  0.0000  0.5000  0.5000  1
  Ge  Ge4  4  0.2218  0.0000  0.1595  1
]