data_[K6Ga12Au10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Ga  1.8100  1.3000  0.7600
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Pmmn]
_cell_length_a [4.4547]
_cell_length_b [13.1469]
_cell_length_c [11.3920]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [59]
_chemical_formula_structural [K3Ga6Au5]
_chemical_formula_sum '[K6 Ga12 Au10]'
_cell_volume [667.1782]
_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  0.0000  0.3567  0.7509  1
  K  K1  2  0.0000  0.0000  0.7423  1
  Ga  Ga2  4  0.0000  0.1816  0.9820  1
  Ga  Ga3  4  0.0000  0.3037  0.4019  1
  Ga  Ga4  2  0.0000  0.5000  0.0383  1
  Ga  Ga5  2  0.0000  0.5000  0.5049  1
  Au  Au6  4  0.0000  0.1156  0.4867  1
  Au  Au7  4  0.0000  0.3195  0.1603  1
  Au  Au8  2  0.0000  0.0000  0.0757  1
]