data_[K4Cd2Cu4Br12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Cd  1.6900  1.5500  1.0900
  Cu  1.9000  1.3500  0.8200
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [13.4102]
_cell_length_b [7.6770]
_cell_length_c [7.7819]
_cell_angle_alpha [90.0000]
_cell_angle_beta [120.9932]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [K2Cd(CuBr3)2]
_chemical_formula_sum '[K4 Cd2 Cu4 Br12]'
_cell_volume [686.7660]
_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  0.2350  0.5000  0.2074  1.0
  Cd  Cd1  2  0.0000  0.5000  0.5000  1.0
  Cu  Cu2  4  0.0491  0.0000  0.2028  1.0
  Br  Br3  8  0.0561  0.2540  0.8036  1.0
  Br  Br4  4  0.2446  0.5000  0.6368  1.0
]