data_[Cs1Cr1Sn2Br8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Cr  1.6600  1.4000  0.9400
  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 [7.3798]
_cell_length_b [7.5753]
_cell_length_c [8.4340]
_cell_angle_alpha [74.5679]
_cell_angle_beta [86.9932]
_cell_angle_gamma [87.8473]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [CsCr(SnBr4)2]
_chemical_formula_sum '[Cs1 Cr1 Sn2 Br8]'
_cell_volume [453.7358]
_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
[
  Cs  Cs0  1  0.0000  0.5000  0.5000  1.0
  Cr  Cr1  1  0.0000  0.0000  0.0000  1.0
  Sn  Sn2  2  0.4462  0.9959  0.7599  1.0
  Br  Br3  2  0.0677  0.9246  0.7261  1.0
  Br  Br4  2  0.2311  0.2509  0.9144  1.0
  Br  Br5  2  0.2491  0.7751  0.1246  1.0
  Br  Br6  2  0.4579  0.2634  0.4615  1.0
]