data_[Ce4Ge4Pd4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Ge  2.0100  1.2500  0.7700
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.4047]
_cell_length_b [4.4616]
_cell_length_c [7.2659]
_cell_angle_alpha [90.0000]
_cell_angle_beta [132.3380]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [CeGePd]
_chemical_formula_sum '[Ce4 Ge4 Pd4]'
_cell_volume [249.3250]
_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  4  0.0386  0.5000  0.3006  1
  Ge  Ge1  4  0.1587  0.0000  0.1005  1
  Pd  Pd2  4  0.1780  0.0000  0.7148  1
]