data_[K4In8Sn4Se24]
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 [14.6698]
_cell_length_b [13.3524]
_cell_length_c [8.4909]
_cell_angle_alpha [90.0000]
_cell_angle_beta [120.7320]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [KIn2SnSe6]
_chemical_formula_sum '[K4 In8 Sn4 Se24]'
_cell_volume [1429.6176]
_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  0.1692  0.2500  1
  In  In1  8  0.1858  0.4246  0.0783  1
  Sn  Sn2  4  0.0000  0.1575  0.7500  1
  Se  Se3  8  0.1121  0.4423  0.3191  1
  Se  Se4  8  0.1150  0.0465  0.6671  1
  Se  Se5  8  0.1358  0.2347  0.0582  1
]