data_[Ce4Ag10Br24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Ag  1.9300  1.6000  1.0867
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.0432]
_cell_length_b [8.2211]
_cell_length_c [10.5522]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.8978]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ce2Ag5Br12]
_chemical_formula_sum '[Ce4 Ag10 Br24]'
_cell_volume [1255.0898]
_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  4  0.0000  0.2485  0.0000  1
  Ag  Ag1  4  0.2049  0.5000  0.7113  1
  Ag  Ag2  4  0.2422  0.5000  0.4509  1
  Ag  Ag3  2  0.0000  0.0000  0.5000  1
  Br  Br4  8  0.1310  0.2491  0.5257  1
  Br  Br5  8  0.1847  0.2507  0.1473  1
  Br  Br6  4  0.0413  0.0000  0.8305  1
  Br  Br7  4  0.0424  0.5000  0.8298  1
]