data_[La8Ge4Pd8]
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 [C2/m]
_cell_length_a [11.2015]
_cell_length_b [4.3311]
_cell_length_c [11.4871]
_cell_angle_alpha [90.0000]
_cell_angle_beta [117.6997]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [La2GePd2]
_chemical_formula_sum '[La8 Ge4 Pd8]'
_cell_volume [493.4268]
_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
[
  La  La0  4  0.0896  0.0000  0.8939  1.0
  La  La1  4  0.1893  0.5000  0.6379  1.0
  Ge  Ge2  4  0.0820  0.5000  0.3185  1.0
  Pd  Pd3  4  0.0459  0.0000  0.4097  1.0
  Pd  Pd4  4  0.1328  0.5000  0.1156  1.0
]