data_[K8La8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  La  1.1000  1.9500  1.1720
]
_symmetry_space_group_name_H-M [P2_12_12_1]
_cell_length_a [7.7934]
_cell_length_b [7.8342]
_cell_length_c [12.4456]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [19]
_chemical_formula_structural [KLa]
_chemical_formula_sum '[K8 La8]'
_cell_volume [759.8695]
_cell_formula_units_Z [8]
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  0.0470  0.9549  0.2452  1
  K  K1  4  0.2340  0.8020  0.5148  1
  La  La2  4  0.0468  0.4289  0.7157  1
  La  La3  4  0.1826  0.6987  0.9646  1
]