data_[K2Te2H2O6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Te  2.1000  1.4000  1.2933
  H  2.2000  0.2500  0.0000
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.9321]
_cell_length_b [6.1765]
_cell_length_c [6.6254]
_cell_angle_alpha [114.5632]
_cell_angle_beta [113.8058]
_cell_angle_gamma [90.1532]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [KTeHO3]
_chemical_formula_sum '[K2 Te2 H2 O6]'
_cell_volume [197.7142]
_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
[
  K  K0  2  0.4107  0.1207  0.7791  1.0
  Te  Te1  2  0.1322  0.4204  0.2989  1.0
  H  H2  2  0.0716  0.9164  0.1658  1.0
  O  O3  2  0.0460  0.2527  0.9370  1.0
  O  O4  2  0.1989  0.6492  0.7404  1.0
  O  O5  2  0.2626  0.1640  0.3597  1.0
]