data_[Ce1In1Sn2Br8]
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
  Sn  1.9600  1.4500  0.8300
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [6.9393]
_cell_length_b [9.1685]
_cell_length_c [7.2954]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.9238]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [CeIn(SnBr4)2]
_chemical_formula_sum '[Ce1 In1 Sn2 Br8]'
_cell_volume [464.0956]
_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
[
  Ce  Ce0  1  0.0000  0.0000  0.0000  1.0
  In  In1  1  0.0000  0.5000  0.0000  1.0
  Sn  Sn2  2  0.5000  0.2552  0.5000  1.0
  Br  Br3  4  0.2437  0.2282  0.1630  1.0
  Br  Br4  2  0.2493  0.0000  0.6746  1.0
  Br  Br5  2  0.2777  0.5000  0.6408  1.0
]