data_[Te4Pb4F24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Te  2.1000  1.4000  1.2933
  Pb  2.3300  1.8000  1.1225
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [4.3913]
_cell_length_b [12.0055]
_cell_length_c [7.8910]
_cell_angle_alpha [90.0000]
_cell_angle_beta [97.8670]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [TePbF6]
_chemical_formula_sum '[Te4 Pb4 F24]'
_cell_volume [412.1028]
_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
[
  Te  Te0  4  0.4114  0.2319  0.0414  1
  Pb  Pb1  4  0.1465  0.5054  0.7860  1
  F  F2  4  0.1476  0.0967  0.9836  1
  F  F3  4  0.1810  0.2037  0.3132  1
  F  F4  4  0.1819  0.6857  0.9512  1
  F  F5  4  0.3024  0.0554  0.5823  1
  F  F6  4  0.3487  0.6137  0.3208  1
  F  F7  4  0.3968  0.6657  0.6430  1
]