data_YNi2Au
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.91
_cell_length_b   5.91
_cell_length_c   5.91
_cell_angle_alpha   38.06
_cell_angle_beta   38.06
_cell_angle_gamma   38.06
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YNi2Au
_chemical_formula_sum   'Y1 Ni2 Au1'
_cell_volume   70.39
_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  Y3  1  0.0  0.0  0.0  1.0
  Ni  Ni1  1  0.0  0.0  0.66  1.0
  Ni  Ni2  1  0.0  0.0  0.76  1.0
  Au  Au0  1  0.0  0.0  0.21  1.0

data_YNi2Au
_symmetry_space_group_name_H-M   Cm
_cell_length_a   6.67
_cell_length_b   3.85
_cell_length_c   5.91
_cell_angle_alpha   90.0
_cell_angle_beta   112.12
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   YNi2Au
_chemical_formula_sum   'Y2 Ni4 Au2'
_cell_volume   140.77
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  2  0.0  0.0  0.0  1.0
  Ni  Ni1  2  -0.0  0.0  0.34  1.0
  Ni  Ni2  2  -0.0  0.0  0.24  1.0
  Au  Au3  2  0.0  0.0  0.79  1.0

Y Ni Ni Au