data_[Cs4Sr12Pd4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Sr  0.9500  2.0000  1.3200
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [9.8820]
_cell_length_b [13.3830]
_cell_length_c [7.7233]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [CsSr3Pd]
_chemical_formula_sum '[Cs4 Sr12 Pd4]'
_cell_volume [1021.4133]
_cell_formula_units_Z [4]
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  4  0.0000  0.4333  0.7500  1
  Sr  Sr1  8  0.2034  0.2791  0.2500  1
  Sr  Sr2  4  0.0000  0.0000  0.0000  1
  Pd  Pd3  4  0.0000  0.1818  0.7500  1
]