data_[Cs1Pd1Br2Cl6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Pd  2.2000  1.4000  0.8462
  Br  2.9600  1.1500  0.8825
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [7.3487]
_cell_length_b [7.6004]
_cell_length_c [7.7073]
_cell_angle_alpha [63.2633]
_cell_angle_beta [82.3807]
_cell_angle_gamma [67.7004]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [CsPd(BrCl3)2]
_chemical_formula_sum '[Cs1 Pd1 Br2 Cl6]'
_cell_volume [355.3174]
_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  0.3979  0.3956  0.7317  1.0
  Pd  Pd1  1  0.0199  0.9537  0.0229  1.0
  Br  Br2  1  0.1733  0.3063  0.2370  1.0
  Br  Br3  1  0.7809  0.9779  0.5344  1.0
  Cl  Cl4  1  0.0721  0.6220  0.2997  1.0
  Cl  Cl5  1  0.2784  0.9954  0.1968  1.0
  Cl  Cl6  1  0.2858  0.8153  0.8633  1.0
  Cl  Cl7  1  0.7483  0.1167  0.1750  1.0
  Cl  Cl8  1  0.7821  0.8653  0.8724  1.0
  Cl  Cl9  1  0.9491  0.2887  0.7642  1.0
]