data_[Ba1Co1Sn2Cl8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Co  1.8800  1.3500  0.7683
  Sn  1.9600  1.4500  0.8300
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.3986]
_cell_length_b [6.7663]
_cell_length_c [8.6466]
_cell_angle_alpha [92.2581]
_cell_angle_beta [90.7826]
_cell_angle_gamma [92.8338]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [BaCo(SnCl4)2]
_chemical_formula_sum '[Ba1 Co1 Sn2 Cl8]'
_cell_volume [373.5620]
_cell_formula_units_Z [1]
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
[
  Ba  Ba0  1  0.0000  0.0000  0.5000  1.0
  Co  Co1  1  0.0000  0.0000  0.0000  1.0
  Sn  Sn2  2  0.4752  0.5316  0.7765  1.0
  Cl  Cl3  2  0.2016  0.1823  0.8017  1.0
  Cl  Cl4  2  0.2200  0.7089  0.9662  1.0
  Cl  Cl5  2  0.2440  0.1274  0.2098  1.0
  Cl  Cl6  2  0.2820  0.6426  0.5254  1.0
]