data_[K8H2Au4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  H  2.2000  0.2500  0.0000
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [7.8468]
_cell_length_b [7.5225]
_cell_length_c [9.3653]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.0879]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [K4HAu2]
_chemical_formula_sum '[K8 H2 Au4]'
_cell_volume [528.4036]
_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  4  0.4848  0.0073  0.2497  1.0
  K  K1  2  0.0651  0.2500  0.9039  1.0
  K  K2  2  0.0728  0.2500  0.3802  1.0
  H  H3  2  0.2432  0.2500  0.1826  1.0
  Au  Au4  2  0.2563  0.7500  0.4443  1.0
  Au  Au5  2  0.2781  0.7500  0.9395  1.0
]