data_[Zn4Ge2Pd16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zn  1.6500  1.3500  0.8800
  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 [13.9090]
_cell_length_b [4.1737]
_cell_length_c [5.9148]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.8536]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Zn2GePd8]
_chemical_formula_sum '[Zn4 Ge2 Pd16]'
_cell_volume [333.3761]
_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
[
  Zn  Zn0  4  0.2152  0.0000  0.6603  1.0
  Ge  Ge1  2  0.0000  0.5000  0.0000  1.0
  Pd  Pd2  4  0.0362  0.0000  0.7509  1.0
  Pd  Pd3  4  0.0963  0.5000  0.4521  1.0
  Pd  Pd4  4  0.1591  0.0000  0.2190  1.0
  Pd  Pd5  4  0.1711  0.5000  0.9256  1.0
]