data_[Hg4Pd2F16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Hg  2.0000  1.5000  1.2450
  Pd  2.2000  1.4000  0.8462
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [9.5710]
_cell_length_b [7.6315]
_cell_length_c [4.7132]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.7837]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Hg2PdF8]
_chemical_formula_sum '[Hg4 Pd2 F16]'
_cell_volume [325.9237]
_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
[
  Hg  Hg0  4  0.1588  0.5000  0.3519  1.0
  Pd  Pd1  2  0.0000  0.0000  0.0000  1.0
  F  F2  8  0.1363  0.1746  0.2486  1.0
  F  F3  4  0.0885  0.5000  0.7997  1.0
  F  F4  4  0.1205  0.0000  0.7356  1.0
]