data_[Mg1Cd1In2Cl6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mg  1.3100  1.5000  0.8600
  Cd  1.6900  1.5500  1.0900
  In  1.7800  1.5500  0.9400
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P4mm]
_cell_length_a [6.9338]
_cell_length_b [6.9338]
_cell_length_c [6.1401]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [99]
_chemical_formula_structural [MgCd(InCl3)2]
_chemical_formula_sum '[Mg1 Cd1 In2 Cl6]'
_cell_volume [295.2015]
_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
[
  Mg  Mg0  1  0.5000  0.5000  0.5842  1.0
  Cd  Cd1  1  0.0000  0.0000  0.5707  1.0
  In  In2  2  0.0000  0.5000  0.0450  1.0
  Cl  Cl3  4  0.2556  0.2556  0.7074  1.0
  Cl  Cl4  1  0.0000  0.0000  0.1690  1.0
  Cl  Cl5  1  0.5000  0.5000  0.2032  1.0
]