data_[Fe1Ag2Pd1F6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Fe  1.8300  1.4000  0.8525
  Ag  1.9300  1.6000  1.0867
  Pd  2.2000  1.4000  0.8462
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.2099]
_cell_length_b [5.4915]
_cell_length_c [5.7679]
_cell_angle_alpha [65.1455]
_cell_angle_beta [74.8016]
_cell_angle_gamma [89.4998]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [FeAg2PdF6]
_chemical_formula_sum '[Fe1 Ag2 Pd1 F6]'
_cell_volume [143.5258]
_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
[
  Fe  Fe0  1  0.0000  0.5000  0.5000  1.0
  Ag  Ag1  2  0.3073  0.1891  0.0260  1.0
  Pd  Pd2  1  0.5000  0.0000  0.5000  1.0
  F  F3  2  0.1016  0.1261  0.6753  1.0
  F  F4  2  0.2561  0.5682  0.1635  1.0
  F  F5  2  0.2712  0.6254  0.6185  1.0
]