data_[Ce2In4Ga2Cl12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  In  1.7800  1.5500  0.9400
  Ga  1.8100  1.3000  0.7600
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [7.4666]
_cell_length_b [8.0936]
_cell_length_c [12.8953]
_cell_angle_alpha [90.0000]
_cell_angle_beta [122.7854]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [CeIn2GaCl6]
_chemical_formula_sum '[Ce2 In4 Ga2 Cl12]'
_cell_volume [655.1436]
_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
[
  Ce  Ce0  2  0.0000  0.0000  0.5000  1.0
  In  In1  4  0.2901  0.0718  0.2671  1.0
  Ga  Ga2  2  0.5000  0.0000  0.0000  1.0
  Cl  Cl3  4  0.1129  0.0513  0.7410  1.0
  Cl  Cl4  4  0.2473  0.7167  0.5718  1.0
  Cl  Cl5  4  0.3544  0.1741  0.5433  1.0
]