data_[K8Li4In4I20]
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
  In  1.7800  1.5500  0.9400
  I  2.6600  1.4000  1.2733
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [5.3712]
_cell_length_b [20.1909]
_cell_length_c [14.2652]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [K2LiInI5]
_chemical_formula_sum '[K8 Li4 In4 I20]'
_cell_volume [1547.0438]
_cell_formula_units_Z [4]
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  0.0000  0.1107  0.6794  1.0
  K  K1  4  0.0000  0.1120  0.3483  1.0
  Li  Li2  4  0.0000  0.2493  0.1129  1.0
  In  In3  4  0.0000  0.4083  0.4477  1.0
  I  I4  4  0.0000  0.0496  0.0093  1.0
  I  I5  4  0.0000  0.2932  0.3160  1.0
  I  I6  4  0.0000  0.3019  0.6263  1.0
  I  I7  4  0.0000  0.3621  0.0124  1.0
  I  I8  4  0.0000  0.4992  0.2716  1.0
]