data_[Na2V2Pd2Se6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  V  1.6300  1.3500  0.7775
  Pd  2.2000  1.4000  0.8462
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [7.8584]
_cell_length_b [3.6202]
_cell_length_c [9.1469]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.7827]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [NaVPdSe3]
_chemical_formula_sum '[Na2 V2 Pd2 Se6]'
_cell_volume [247.7862]
_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
[
  Na  Na0  2  0.2178  0.7500  0.2586  1
  V  V1  2  0.3150  0.2500  0.8172  1
  Pd  Pd2  2  0.1232  0.7500  0.5849  1
  Se  Se3  2  0.1118  0.7500  0.8587  1
  Se  Se4  2  0.3224  0.2500  0.5552  1
  Se  Se5  2  0.4348  0.2500  0.1195  1
]