data_[Na4Tl1In2Bi2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Tl  1.6200  1.9000  1.3325
  In  1.7800  1.5500  0.9400
  Bi  2.0200  1.6000  1.0350
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.0394]
_cell_length_b [6.4939]
_cell_length_c [7.9081]
_cell_angle_alpha [88.7363]
_cell_angle_beta [73.8271]
_cell_angle_gamma [73.4586]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Na4Tl(InBi)2]
_chemical_formula_sum '[Na4 Tl1 In2 Bi2]'
_cell_volume [284.9942]
_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
[
  Na  Na0  2  0.1560  0.1378  0.5886  1.0
  Na  Na1  2  0.3513  0.3230  0.1588  1.0
  Tl  Tl2  1  0.0000  0.0000  0.0000  1.0
  In  In3  2  0.2154  0.6190  0.6375  1.0
  Bi  Bi4  2  0.4337  0.7870  0.2563  1.0
]