data_YMgAu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.67
_cell_length_b   4.67
_cell_length_c   5.18
_cell_angle_alpha   113.27
_cell_angle_beta   113.27
_cell_angle_gamma   57.97
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YMgAu2
_chemical_formula_sum   'Y1 Mg1 Au2'
_cell_volume   85.47
_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  0.91  0.0  0.31  1.0
  Mg  Mg2  1  0.0  0.0  0.0  1.0
  Au  Au0  1  0.52  0.0  0.84  1.0
  Au  Au1  1  0.3  0.0  0.78  1.0

data_YMgAu2
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.52
_cell_length_b   4.67
_cell_length_c   5.18
_cell_angle_alpha   113.27
_cell_angle_beta   90.0
_cell_angle_gamma   118.99
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YMgAu2
_chemical_formula_sum   'Y1 Mg1 Au2'
_cell_volume   85.47
_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  0.0  0.09  0.69  1.0
  Mg  Mg1  1  0.0  0.0  0.0  1.0
  Au  Au2  1  0.0  0.48  0.16  1.0
  Au  Au3  1  0.0  0.7  0.22  1.0

Y Mg Au Au