data_[Zr4Tl8Ga4Cl24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zr  1.3300  1.5500  0.8600
  Tl  1.6200  1.9000  1.3325
  Ga  1.8100  1.3000  0.7600
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [Fm-3m]
_cell_length_a [10.7194]
_cell_length_b [10.7194]
_cell_length_c [10.7194]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [225]
_chemical_formula_structural [ZrTl2GaCl6]
_chemical_formula_sum '[Zr4 Tl8 Ga4 Cl24]'
_cell_volume [1231.7014]
_cell_formula_units_Z [4]
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
[
  Zr  Zr0  4  0.0000  0.0000  0.5000  1
  Tl  Tl1  8  0.2500  0.2500  0.2500  1
  Ga  Ga2  4  0.0000  0.0000  0.0000  1
  Cl  Cl3  24  0.0000  0.0000  0.2639  1
]