data_[Cs2Tm2Cu2Cl12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Tm  1.2500  1.7500  1.0950
  Cu  1.9000  1.3500  0.8200
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2]
_cell_length_a [7.1739]
_cell_length_b [10.8802]
_cell_length_c [7.7573]
_cell_angle_alpha [90.0000]
_cell_angle_beta [96.8884]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [5]
_chemical_formula_structural [CsTmCuCl6]
_chemical_formula_sum '[Cs2 Tm2 Cu2 Cl12]'
_cell_volume [601.1119]
_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  0.0396  0.5000  1.0
  Tm  Tm1  2  0.0000  0.6781  0.0000  1.0
  Cu  Cu2  2  0.0000  0.3302  0.0000  1.0
  Cl  Cl3  4  0.1105  0.4801  0.1919  1.0
  Cl  Cl4  4  0.1737  0.8073  0.2365  1.0
  Cl  Cl5  4  0.1869  0.1826  0.1498  1.0
]