data_[K3Dy3Ga6Br18]
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
  Ga  1.8100  1.3000  0.7600
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [R3]
_cell_length_a [7.8404]
_cell_length_b [7.8404]
_cell_length_c [20.8865]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [146]
_chemical_formula_structural [KDy(GaBr3)2]
_chemical_formula_sum '[K3 Dy3 Ga6 Br18]'
_cell_volume [1111.9217]
_cell_formula_units_Z [3]
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  3  0.0000  0.0000  0.1852  1.0
  Dy  Dy1  3  0.0000  0.0000  0.6755  1.0
  Ga  Ga2  3  0.0000  0.0000  0.4837  1.0
  Ga  Ga3  3  0.0000  0.0000  0.9898  1.0
  Br  Br4  9  0.0153  0.7275  0.5885  1.0
  Br  Br5  9  0.0177  0.3773  0.4127  1.0
]