data_[K4In4Sn8Se24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  In  1.7800  1.5500  0.9400
  Sn  1.9600  1.4500  0.8300
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [14.7557]
_cell_length_b [13.1149]
_cell_length_c [7.6470]
_cell_angle_alpha [90.0000]
_cell_angle_beta [116.3994]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [KIn(SnSe3)2]
_chemical_formula_sum '[K4 In4 Sn8 Se24]'
_cell_volume [1325.5215]
_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  0.3092  0.7500  1.0
  In  In1  4  0.0000  0.1658  0.2500  1.0
  Sn  Sn2  8  0.2148  0.4120  0.3327  1.0
  Se  Se3  8  0.0982  0.0665  0.5860  1.0
  Se  Se4  8  0.1162  0.4661  0.5256  1.0
  Se  Se5  8  0.1539  0.2323  0.1937  1.0
]