data_[Rb4Tl1In3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Tl  1.6200  1.9000  1.3325
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [P-4m2]
_cell_length_a [5.8830]
_cell_length_b [5.8830]
_cell_length_c [8.3217]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [115]
_chemical_formula_structural [Rb4TlIn3]
_chemical_formula_sum '[Rb4 Tl1 In3]'
_cell_volume [288.0089]
_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
[
  Rb  Rb0  2  0.0000  0.5000  0.2490  1
  Rb  Rb1  1  0.0000  0.0000  0.5000  1
  Rb  Rb2  1  0.5000  0.5000  0.0000  1
  Tl  Tl3  1  0.0000  0.0000  0.0000  1
  In  In4  2  0.0000  0.5000  0.7462  1
  In  In5  1  0.5000  0.5000  0.5000  1
]