data_[Cs2Tm2Cd2S6]
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
  Cd  1.6900  1.5500  1.0900
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [9.1914]
_cell_length_b [4.1278]
_cell_length_c [10.2791]
_cell_angle_alpha [90.0000]
_cell_angle_beta [111.2965]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [CsTmCdS3]
_chemical_formula_sum '[Cs2 Tm2 Cd2 S6]'
_cell_volume [363.3596]
_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  0.2245  0.2500  0.2412  1.0
  Tm  Tm1  2  0.3338  0.7500  0.8698  1.0
  Cd  Cd2  2  0.0845  0.2500  0.6162  1.0
  S  S3  2  0.1315  0.2500  0.8703  1.0
  S  S4  2  0.2156  0.7500  0.5572  1.0
  S  S5  2  0.4781  0.7500  0.1429  1.0
]