data_[Cs2Co2Cu4Br16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Co  1.8800  1.3500  0.7683
  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 [10.3128]
_cell_length_b [7.2355]
_cell_length_c [10.6779]
_cell_angle_alpha [90.0000]
_cell_angle_beta [91.3138]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [CsCo(CuBr4)2]
_chemical_formula_sum '[Cs2 Co2 Cu4 Br16]'
_cell_volume [796.5513]
_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
[
  Cs  Cs0  2  0.0000  0.0000  0.5000  1
  Co  Co1  2  0.0000  0.0000  0.0000  1
  Cu  Cu2  4  0.1408  0.5000  0.8181  1
  Br  Br3  8  0.0049  0.2300  0.1654  1
  Br  Br4  4  0.1615  0.5000  0.6007  1
  Br  Br5  4  0.2350  0.0000  0.9928  1
]