data_[Zn2Ge4Pd16]
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 [14.2362]
_cell_length_b [4.1132]
_cell_length_c [6.1948]
_cell_angle_alpha [90.0000]
_cell_angle_beta [110.9228]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Zn(GePd4)2]
_chemical_formula_sum '[Zn2 Ge4 Pd16]'
_cell_volume [338.8275]
_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
  Ge  Ge1  4  0.1889  0.0000  0.6779  1.0
  Pd  Pd2  4  0.0304  0.0000  0.7628  1.0
  Pd  Pd3  4  0.0966  0.5000  0.4661  1.0
  Pd  Pd4  4  0.1734  0.5000  0.9486  1.0
  Pd  Pd5  4  0.1793  0.0000  0.2677  1.0
]