data_[Na2In2Fe2Cl8]
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
  Fe  1.8300  1.4000  0.8525
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [6.9011]
_cell_length_b [7.1428]
_cell_length_c [8.4987]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.7584]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [NaInFeCl4]
_chemical_formula_sum '[Na2 In2 Fe2 Cl8]'
_cell_volume [401.1345]
_cell_formula_units_Z [2]
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  2  0.2151  0.2500  0.5558  1
  In  In1  2  0.2533  0.2500  0.0729  1
  Fe  Fe2  2  0.2436  0.7500  0.3246  1
  Cl  Cl3  4  0.0199  0.5027  0.2812  1
  Cl  Cl4  2  0.4420  0.7500  0.1509  1
  Cl  Cl5  2  0.4572  0.7500  0.5861  1
]