data_[Fe2Cu6Pd8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Fe  1.8300  1.4000  0.8525
  Cu  1.9000  1.3500  0.8200
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [17.7015]
_cell_length_b [2.7318]
_cell_length_c [4.8084]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.0275]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [FeCu3Pd4]
_chemical_formula_sum '[Fe2 Cu6 Pd8]'
_cell_volume [224.5698]
_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
[
  Fe  Fe0  2  0.0000  0.5000  0.0000  1.0
  Cu  Cu1  4  0.2500  0.5000  0.2489  1.0
  Cu  Cu2  2  0.0000  0.0000  0.5000  1.0
  Pd  Pd3  4  0.1242  0.5000  0.7931  1.0
  Pd  Pd4  4  0.1243  0.0000  0.2939  1.0
]