data_[Te2As2Xe2O4F22]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Te  2.1000  1.4000  1.2933
  As  2.1800  1.1500  0.6600
  Xe  2.6000  2.16  0.6200
  O  3.4400  0.6000  1.2600
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.4276]
_cell_length_b [7.4382]
_cell_length_c [14.2121]
_cell_angle_alpha [89.4943]
_cell_angle_beta [84.1143]
_cell_angle_gamma [84.2107]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [TeAsXeO2F11]
_chemical_formula_sum '[Te2 As2 Xe2 O4 F22]'
_cell_volume [567.8363]
_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
[
  Te  Te0  2  0.2689  0.7337  0.6322  1
  As  As1  2  0.3931  0.7641  0.1261  1
  Xe  Xe2  2  0.1340  0.7368  0.8801  1
  O  O3  2  0.0670  0.6576  0.7460  1
  O  O4  2  0.1882  0.5246  0.5567  1
  F  F5  2  0.0143  0.1241  0.4033  1
  F  F6  2  0.0828  0.3907  0.6175  1
  F  F7  2  0.1523  0.8243  0.0355  1
  F  F8  2  0.1592  0.8599  0.2102  1
  F  F9  2  0.2701  0.5536  0.1377  1
  F  F10  2  0.3648  0.9351  0.6920  1
  F  F11  2  0.3891  0.2920  0.7942  1
  F  F12  2  0.4014  0.3222  0.9714  1
  F  F13  2  0.4370  0.3975  0.3343  1
  F  F14  2  0.4389  0.7955  0.5170  1
  F  F15  2  0.4902  0.9809  0.1034  1
]