data_[Zr4Sb4Pd14Au2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zr  1.3300  1.5500  0.8600
  Sb  2.0500  1.4500  0.8300
  Pd  2.2000  1.4000  0.8462
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [5.4334]
_cell_length_b [5.3906]
_cell_length_c [15.6517]
_cell_angle_alpha [90.0000]
_cell_angle_beta [96.6366]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Zr2Sb2Pd7Au]
_chemical_formula_sum '[Zr4 Sb4 Pd14 Au2]'
_cell_volume [455.3555]
_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
[
  Zr  Zr0  4  0.0863  0.5000  0.2631  1
  Sb  Sb1  4  0.1468  0.0000  0.3761  1
  Pd  Pd2  8  0.2036  0.2496  0.8598  1
  Pd  Pd3  4  0.2156  0.5000  0.4543  1
  Pd  Pd4  2  0.0000  0.5000  0.0000  1
  Au  Au5  2  0.0000  0.0000  0.0000  1
]