data_[Li2Ce1Sn1Br8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Ce  1.1200  1.8500  1.0800
  Sn  1.9600  1.4500  0.8300
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [7.0150]
_cell_length_b [7.2144]
_cell_length_c [8.8406]
_cell_angle_alpha [73.0922]
_cell_angle_beta [89.9684]
_cell_angle_gamma [77.8679]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Li2CeSnBr8]
_chemical_formula_sum '[Li2 Ce1 Sn1 Br8]'
_cell_volume [417.6340]
_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
[
  Li  Li0  2  0.4558  0.3534  0.6712  1
  Ce  Ce1  1  0.0000  0.0000  0.0000  1
  Sn  Sn2  1  0.0000  0.0000  0.5000  1
  Br  Br3  2  0.1166  0.2350  0.7072  1
  Br  Br4  2  0.1186  0.2175  0.1846  1
  Br  Br5  2  0.3663  0.7486  0.0548  1
  Br  Br6  2  0.3890  0.7304  0.5636  1
]