data_[K2Hg14Pd10]
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
]
_symmetry_space_group_name_H-M [Imm2]
_cell_length_a [5.8120]
_cell_length_b [9.8349]
_cell_length_c [9.6398]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [44]
_chemical_formula_structural [KHg7Pd5]
_chemical_formula_sum '[K2 Hg14 Pd10]'
_cell_volume [551.0166]
_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  0.0000  0.9976  1.0
  Hg  Hg1  4  0.0000  0.3074  0.5101  1.0
  Hg  Hg2  4  0.0000  0.3349  0.9914  1.0
  Hg  Hg3  2  0.0000  0.0000  0.3230  1.0
  Hg  Hg4  2  0.0000  0.0000  0.6623  1.0
  Hg  Hg5  2  0.0000  0.5000  0.2652  1.0
  Pd  Pd6  8  0.2459  0.2519  0.2512  1.0
  Pd  Pd7  2  0.0000  0.5000  0.7443  1.0
]