data_[Cs4La2In2Br12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  La  1.1000  1.9500  1.1720
  In  1.7800  1.5500  0.9400
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [8.3493]
_cell_length_b [8.7886]
_cell_length_c [14.5684]
_cell_angle_alpha [90.0000]
_cell_angle_beta [124.3561]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Cs2LaInBr6]
_chemical_formula_sum '[Cs4 La2 In2 Br12]'
_cell_volume [882.5190]
_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
[
  Cs  Cs0  4  0.2728  0.5672  0.7508  1.0
  La  La1  2  0.0000  0.0000  0.5000  1.0
  In  In2  2  0.5000  0.0000  0.0000  1.0
  Br  Br3  4  0.1446  0.5264  0.2365  1.0
  Br  Br4  4  0.2319  0.2202  0.0486  1.0
  Br  Br5  4  0.3307  0.6869  0.0446  1.0
]