data_[K2La2Cl6]
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
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.6060]
_cell_length_b [7.1529]
_cell_length_c [8.4889]
_cell_angle_alpha [68.6441]
_cell_angle_beta [78.1691]
_cell_angle_gamma [68.5516]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [KLaCl3]
_chemical_formula_sum '[K2 La2 Cl6]'
_cell_volume [294.0530]
_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  0.1454  0.2010  0.5224  1.0
  La  La1  2  0.4344  0.2877  0.9865  1.0
  Cl  Cl2  2  0.0654  0.6141  0.1522  1.0
  Cl  Cl3  2  0.3394  0.7117  0.7301  1.0
  Cl  Cl4  2  0.3565  0.9222  0.2730  1.0
]