data_[Sr1Li2Ce1Br8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Li  0.9800  1.4500  0.9000
  Ce  1.1200  1.8500  1.0800
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [7.0184]
_cell_length_b [7.2870]
_cell_length_c [9.0399]
_cell_angle_alpha [72.0130]
_cell_angle_beta [89.6562]
_cell_angle_gamma [78.9603]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [SrLi2CeBr8]
_chemical_formula_sum '[Sr1 Li2 Ce1 Br8]'
_cell_volume [430.8937]
_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
[
  Sr  Sr0  1  0.0000  0.0000  0.5000  1.0
  Li  Li1  2  0.4614  0.3577  0.6736  1.0
  Ce  Ce2  1  0.0000  0.0000  0.0000  1.0
  Br  Br3  2  0.1200  0.2213  0.1723  1.0
  Br  Br4  2  0.1211  0.2383  0.7108  1.0
  Br  Br5  2  0.3618  0.7520  0.0561  1.0
  Br  Br6  2  0.3964  0.7298  0.5572  1.0
]