data_[Ba4Sr2La4Tl10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Sr  0.9500  2.0000  1.3200
  La  1.1000  1.9500  1.1720
  Tl  1.6200  1.9000  1.3325
]
_symmetry_space_group_name_H-M [P4/mbm]
_cell_length_a [13.0718]
_cell_length_b [13.0718]
_cell_length_c [4.3380]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [127]
_chemical_formula_structural [Ba2SrLa2Tl5]
_chemical_formula_sum '[Ba4 Sr2 La4 Tl10]'
_cell_volume [741.2337]
_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
[
  Ba  Ba0  4  0.1726  0.3274  0.0000  1
  Sr  Sr1  2  0.0000  0.0000  0.0000  1
  La  La2  4  0.1303  0.6303  0.0000  1
  Tl  Tl3  8  0.0731  0.8143  0.5000  1
  Tl  Tl4  2  0.0000  0.5000  0.5000  1
]