data_[Cs1Tm1Pb2Cl8]
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
  Pb  2.3300  1.8000  1.1225
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.6229]
_cell_length_b [6.8783]
_cell_length_c [9.2853]
_cell_angle_alpha [85.8601]
_cell_angle_beta [85.5393]
_cell_angle_gamma [87.7528]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [CsTm(PbCl4)2]
_chemical_formula_sum '[Cs1 Tm1 Pb2 Cl8]'
_cell_volume [420.3615]
_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
[
  Cs  Cs0  1  0.0000  0.0000  0.5000  1.0
  Tm  Tm1  1  0.0000  0.0000  0.0000  1.0
  Pb  Pb2  2  0.4878  0.4941  0.7511  1.0
  Cl  Cl3  2  0.2277  0.8362  0.1949  1.0
  Cl  Cl4  2  0.2335  0.3078  0.9857  1.0
  Cl  Cl5  2  0.2419  0.8495  0.7973  1.0
  Cl  Cl6  2  0.2687  0.3984  0.5315  1.0
]