data_[Cs3Tl2In4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Tl  1.6200  1.9000  1.3325
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.4952]
_cell_length_b [7.7236]
_cell_length_c [10.4928]
_cell_angle_alpha [73.5964]
_cell_angle_beta [77.8450]
_cell_angle_gamma [69.9690]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Cs3(TlIn2)2]
_chemical_formula_sum '[Cs3 Tl2 In4]'
_cell_volume [398.1617]
_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  2  0.3846  0.8707  0.3575  1.0
  Cs  Cs1  1  0.0000  0.0000  0.0000  1.0
  Tl  Tl2  2  0.3006  0.6467  0.7513  1.0
  In  In3  2  0.0976  0.4513  0.3660  1.0
  In  In4  2  0.2628  0.4006  0.0722  1.0
]