data_[Ce3Fe1Co2Ge6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Fe  1.8300  1.4000  0.8525
  Co  1.8800  1.3500  0.7683
  Ge  2.0100  1.2500  0.7700
]
_symmetry_space_group_name_H-M [P-3m1]
_cell_length_a [6.1472]
_cell_length_b [6.1472]
_cell_length_c [6.9698]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [164]
_chemical_formula_structural [Ce3Fe(CoGe3)2]
_chemical_formula_sum '[Ce3 Fe1 Co2 Ge6]'
_cell_volume [228.0872]
_cell_formula_units_Z [1]
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  0.3333  0.6667  0.7353  1
  Ce  Ce1  1  0.0000  0.0000  0.0000  1
  Fe  Fe2  1  0.0000  0.0000  0.5000  1
  Co  Co3  2  0.3333  0.6667  0.0395  1
  Ge  Ge4  6  0.1905  0.3809  0.3177  1
]