data_[Cs2Tl2Co2Br8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Tl  1.6200  1.9000  1.3325
  Co  1.8800  1.3500  0.7683
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [7.2306]
_cell_length_b [7.7329]
_cell_length_c [10.2410]
_cell_angle_alpha [90.0000]
_cell_angle_beta [110.0943]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [CsTlCoBr4]
_chemical_formula_sum '[Cs2 Tl2 Co2 Br8]'
_cell_volume [537.7551]
_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  0.3087  0.2500  0.0886  1.0
  Tl  Tl1  2  0.2054  0.2500  0.5364  1.0
  Co  Co2  2  0.1930  0.7500  0.2951  1.0
  Br  Br3  4  0.0185  0.0007  0.7584  1.0
  Br  Br4  2  0.3758  0.7500  0.5405  1.0
  Br  Br5  2  0.4082  0.7500  0.1601  1.0
]