data_[K4Pu3In1Te8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Pu  1.2800  1.7500  0.9675
  In  1.7800  1.5500  0.9400
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [7.8086]
_cell_length_b [7.8086]
_cell_length_c [8.5024]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [123]
_chemical_formula_structural [K4Pu3InTe8]
_chemical_formula_sum '[K4 Pu3 In1 Te8]'
_cell_volume [518.4213]
_cell_formula_units_Z [1]
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  0.0000  0.5000  0.0000  1
  K  K1  1  0.0000  0.0000  0.0000  1
  K  K2  1  0.5000  0.5000  0.0000  1
  Pu  Pu3  2  0.0000  0.5000  0.5000  1
  Pu  Pu4  1  0.0000  0.0000  0.5000  1
  In  In5  1  0.5000  0.5000  0.5000  1
  Te  Te6  8  0.2417  0.2417  0.2852  1
]