data_[Sr2Tl4Co2Cl12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Tl  1.6200  1.9000  1.3325
  Co  1.8800  1.3500  0.7683
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [7.2982]
_cell_length_b [7.4760]
_cell_length_c [12.6830]
_cell_angle_alpha [90.0000]
_cell_angle_beta [124.5714]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [SrTl2CoCl6]
_chemical_formula_sum '[Sr2 Tl4 Co2 Cl12]'
_cell_volume [569.8124]
_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
[
  Sr  Sr0  2  0.5000  0.0000  0.0000  1.0
  Tl  Tl1  4  0.2313  0.5584  0.7472  1.0
  Co  Co2  2  0.0000  0.0000  0.5000  1.0
  Cl  Cl3  4  0.1414  0.7263  0.4584  1.0
  Cl  Cl4  4  0.2351  0.1857  0.4605  1.0
  Cl  Cl5  4  0.3089  0.5133  0.2288  1.0
]