data_[Cs6H10Pd2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  H  2.2000  0.2500  0.0000
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P4/mbm]
_cell_length_a [8.3320]
_cell_length_b [8.3320]
_cell_length_c [6.3280]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [127]
_chemical_formula_structural [Cs3H5Pd]
_chemical_formula_sum '[Cs6 H10 Pd2]'
_cell_volume [439.3043]
_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
[
  Cs  Cs0  4  0.1835  0.3165  0.5000  1.0
  Cs  Cs1  2  0.0000  0.0000  0.0000  1.0
  H  H2  8  0.1006  0.6006  0.1865  1.0
  H  H3  2  0.0000  0.0000  0.5000  1.0
  Pd  Pd4  2  0.0000  0.5000  0.0000  1.0
]