data_[K2Hg2Pd2F12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  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]
_cell_length_a [6.1618]
_cell_length_b [10.0883]
_cell_length_c [5.2981]
_cell_angle_alpha [90.0000]
_cell_angle_beta [91.0145]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [5]
_chemical_formula_structural [KHgPdF6]
_chemical_formula_sum '[K2 Hg2 Pd2 F12]'
_cell_volume [329.2868]
_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
[
  K  K0  2  0.0000  0.0007  0.5000  1.0
  Hg  Hg1  2  0.0000  0.6746  0.0000  1.0
  Pd  Pd2  2  0.0000  0.3335  0.0000  1.0
  F  F3  4  0.1350  0.4807  0.2018  1.0
  F  F4  4  0.1495  0.1937  0.2065  1.0
  F  F5  4  0.2018  0.8205  0.2266  1.0
]