data_[Y2Ag1Au1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  Ag  1.9300  1.6000  1.0867
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Pm]
_cell_length_a [3.7428]
_cell_length_b [4.7453]
_cell_length_c [5.7477]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.7917]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [6]
_chemical_formula_structural [Y2AgAu]
_chemical_formula_sum '[Y2 Ag1 Au1]'
_cell_volume [98.2288]
_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
[
  Y  Y0  1  0.0011  0.0000  0.0958  1.0
  Y  Y1  1  0.2509  0.5000  0.6545  1.0
  Ag  Ag2  1  0.7000  0.0000  0.5438  1.0
  Au  Au3  1  0.5480  0.5000  0.2058  1.0
]