data_[Ni2Bi16Pd4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ni  1.9100  1.3500  0.7400
  Bi  2.0200  1.6000  1.0350
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.7217]
_cell_length_b [10.3273]
_cell_length_c [5.6248]
_cell_angle_alpha [90.0000]
_cell_angle_beta [93.3160]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ni(Bi4Pd)2]
_chemical_formula_sum '[Ni2 Bi16 Pd4]'
_cell_volume [679.7652]
_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
[
  Ni  Ni0  2  0.0000  0.0000  0.0000  1
  Bi  Bi1  8  0.0699  0.2102  0.2702  1
  Bi  Bi2  4  0.0577  0.5000  0.7580  1
  Bi  Bi3  4  0.1828  0.0000  0.7465  1
  Pd  Pd4  4  0.2147  0.0000  0.2505  1
]