data_[K2Li2Ti2Te6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Li  0.9800  1.4500  0.9000
  Ti  1.5400  1.4000  0.8517
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [8.7869]
_cell_length_b [4.0769]
_cell_length_c [10.8689]
_cell_angle_alpha [90.0000]
_cell_angle_beta [111.6103]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [KLiTiTe3]
_chemical_formula_sum '[K2 Li2 Ti2 Te6]'
_cell_volume [361.9942]
_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  0.2693  0.2500  0.2975  1.0
  Li  Li1  2  0.0711  0.2500  0.6036  1.0
  Ti  Ti2  2  0.3062  0.7500  0.8375  1.0
  Te  Te3  2  0.0967  0.2500  0.8583  1.0
  Te  Te4  2  0.2606  0.7500  0.5743  1.0
  Te  Te5  2  0.4503  0.7500  0.1198  1.0
]