data_[Ce2Cr2Ge4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Cr  1.6600  1.4000  0.9400
  Ge  2.0100  1.2500  0.7700
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [4.6555]
_cell_length_b [4.0677]
_cell_length_c [8.5109]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.4199]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [CeCrGe2]
_chemical_formula_sum '[Ce2 Cr2 Ge4]'
_cell_volume [158.5143]
_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  0.0736  0.7500  0.1982  1
  Cr  Cr1  2  0.3848  0.7500  0.6111  1
  Ge  Ge2  2  0.1594  0.2500  0.4707  1
  Ge  Ge3  2  0.4565  0.7500  0.9041  1
]