data_[Zn2Si4Pd16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zn  1.6500  1.3500  0.8800
  Si  1.9000  1.1000  0.5400
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [14.5885]
_cell_length_b [3.9714]
_cell_length_c [6.0532]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.1367]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Zn(SiPd4)2]
_chemical_formula_sum '[Zn2 Si4 Pd16]'
_cell_volume [331.3188]
_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  2  0.0000  0.5000  0.0000  1.0
  Si  Si1  4  0.1842  0.0000  0.6937  1.0
  Pd  Pd2  4  0.0317  0.0000  0.7620  1.0
  Pd  Pd3  4  0.0954  0.5000  0.4755  1.0
  Pd  Pd4  4  0.1753  0.5000  0.9622  1.0
  Pd  Pd5  4  0.1961  0.0000  0.3084  1.0
]