data_[Na4In4Cl16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  In  1.7800  1.5500  0.9400
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [8.1619]
_cell_length_b [15.8461]
_cell_length_c [6.5490]
_cell_angle_alpha [90.0000]
_cell_angle_beta [124.5739]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [NaInCl4]
_chemical_formula_sum '[Na4 In4 Cl16]'
_cell_volume [697.4290]
_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
[
  Na  Na0  4  0.0000  0.4082  0.7500  1
  In  In1  4  0.0000  0.0795  0.2500  1
  Cl  Cl2  8  0.2198  0.9563  0.2296  1
  Cl  Cl3  8  0.2221  0.1806  0.2501  1
]