data_[K2Dy1Au1Br6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Dy  1.2200  1.7500  1.1310
  Au  2.5400  1.3500  1.0700
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [7.8488]
_cell_length_b [8.2180]
_cell_length_c [8.4799]
_cell_angle_alpha [94.7677]
_cell_angle_beta [114.7099]
_cell_angle_gamma [118.3755]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [K2DyAuBr6]
_chemical_formula_sum '[K2 Dy1 Au1 Br6]'
_cell_volume [409.1192]
_cell_formula_units_Z [1]
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  1  0.8942  0.4437  0.3789  1.0
  K  K1  1  0.9622  0.9675  0.9561  1.0
  Dy  Dy2  1  0.3319  0.6691  0.0237  1.0
  Au  Au3  1  0.6366  0.4093  0.7538  1.0
  Br  Br4  1  0.1860  0.7665  0.2316  1.0
  Br  Br5  1  0.1879  0.8326  0.7668  1.0
  Br  Br6  1  0.4187  0.5498  0.7300  1.0
  Br  Br7  1  0.4198  0.4182  0.1870  1.0
  Br  Br8  1  0.7710  0.9921  0.2303  1.0
  Br  Br9  1  0.8686  0.2896  0.7568  1.0
]