data_[Tl2In2Co2Cl12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  In  1.7800  1.5500  0.9400
  Co  1.8800  1.3500  0.7683
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2]
_cell_length_a [6.6432]
_cell_length_b [10.9986]
_cell_length_c [7.1401]
_cell_angle_alpha [90.0000]
_cell_angle_beta [92.1575]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [5]
_chemical_formula_structural [TlInCoCl6]
_chemical_formula_sum '[Tl2 In2 Co2 Cl12]'
_cell_volume [521.3312]
_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
[
  Tl  Tl0  2  0.0000  0.0002  0.5000  1.0
  In  In1  2  0.0000  0.6740  0.0000  1.0
  Co  Co2  2  0.0000  0.3358  0.0000  1.0
  Cl  Cl3  4  0.1224  0.4855  0.1924  1.0
  Cl  Cl4  4  0.1678  0.1921  0.1813  1.0
  Cl  Cl5  4  0.1892  0.8170  0.2155  1.0
]