data_Y2RhAu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.42
_cell_length_b   3.63
_cell_length_c   7.02
_cell_angle_alpha   90.0
_cell_angle_beta   91.79
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Y2RhAu
_chemical_formula_sum   'Y2 Rh1 Au1'
_cell_volume   87.2
_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  Y2  1  0.61  0.81  0.67  1.0
  Y  Y3  1  0.6  0.81  0.35  1.0
  Rh  Rh1  1  0.0  0.0  0.0  1.0
  Au  Au0  1  0.89  0.0  0.51  1.0

data_Y2RhAu
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.42
_cell_length_b   3.63
_cell_length_c   7.02
_cell_angle_alpha   90.0
_cell_angle_beta   91.79
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Y2RhAu
_chemical_formula_sum   'Y2 Rh1 Au1'
_cell_volume   87.2
_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  0.6  0.81  0.35  1.0
  Y  Y1  1  0.61  0.81  0.67  1.0
  Rh  Rh2  1  0.0  0.0  0.0  1.0
  Au  Au3  1  0.89  0.0  0.51  1.0

Y Y Rh Au
Y Y Rh Au 0 3 o + o 0 2 + + + 0 2 o + + 1 3 o + o 1 2 + + o 1 2 o + o 2 3 - o - 2 3 - o o 2 2 + o o 2 2 o + o 