data_[K4Li4Ti2]
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
]
_symmetry_space_group_name_H-M [P4/mbm]
_cell_length_a [9.9443]
_cell_length_b [9.9443]
_cell_length_c [3.4091]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [127]
_chemical_formula_structural [K2Li2Ti]
_chemical_formula_sum '[K4 Li4 Ti2]'
_cell_volume [337.1214]
_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  4  0.1396  0.3604  0.0000  1
  Li  Li1  4  0.1697  0.6697  0.5000  1
  Ti  Ti2  2  0.0000  0.0000  0.0000  1
]