data_[K4Sc2Ag2Cl12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Sc  1.3600  1.6000  0.8850
  Ag  1.9300  1.6000  1.0867
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [7.2024]
_cell_length_b [7.4889]
_cell_length_c [12.3798]
_cell_angle_alpha [90.0000]
_cell_angle_beta [125.2196]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [K2ScAgCl6]
_chemical_formula_sum '[K4 Sc2 Ag2 Cl12]'
_cell_volume [545.5057]
_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  0.2685  0.5667  0.7499  1.0
  Sc  Sc1  2  0.0000  0.0000  0.5000  1.0
  Ag  Ag2  2  0.5000  0.0000  0.0000  1.0
  Cl  Cl3  4  0.1557  0.5176  0.2411  1.0
  Cl  Cl4  4  0.2268  0.2206  0.0428  1.0
  Cl  Cl5  4  0.3254  0.6869  0.0425  1.0
]