data_[La4Ge2Pd10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Ge  2.0100  1.2500  0.7700
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [I4mm]
_cell_length_a [6.2004]
_cell_length_b [6.2004]
_cell_length_c [8.5784]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [107]
_chemical_formula_structural [La2GePd5]
_chemical_formula_sum '[La4 Ge2 Pd10]'
_cell_volume [329.7986]
_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
[
  La  La0  4  0.0000  0.5000  0.2536  1.0
  Ge  Ge1  2  0.0000  0.0000  0.9318  1.0
  Pd  Pd2  8  0.2237  0.7763  0.5086  1.0
  Pd  Pd3  2  0.0000  0.0000  0.2486  1.0
]