data_[Y8Ni2Au2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  Ni  1.9100  1.3500  0.7400
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [6.9138]
_cell_length_b [7.0106]
_cell_length_c [6.8954]
_cell_angle_alpha [90.0000]
_cell_angle_beta [94.1003]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Y4NiAu]
_chemical_formula_sum '[Y8 Ni2 Au2]'
_cell_volume [333.3632]
_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
[
  Y  Y0  4  0.1749  0.6540  0.8692  1
  Y  Y1  4  0.3460  0.1636  0.8178  1
  Ni  Ni2  2  0.5000  0.0000  0.5000  1
  Au  Au3  2  0.0000  0.0000  0.0000  1
]