data_Y2PdRu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.9
_cell_length_b   4.9
_cell_length_c   4.9
_cell_angle_alpha   121.29
_cell_angle_beta   119.84
_cell_angle_gamma   89.04
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Y2PdRu
_chemical_formula_sum   'Y2 Pd1 Ru1'
_cell_volume   82.67
_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  0.0  0.46  0.75  1.0
  Y  Y3  1  0.4  0.0  0.75  1.0
  Pd  Pd0  1  0.0  0.0  0.5  1.0
  Ru  Ru1  1  0.0  0.0  0.0  1.0

data_Y2PdRu
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.81
_cell_length_b   4.9
_cell_length_c   4.9
_cell_angle_alpha   60.16
_cell_angle_beta   60.64
_cell_angle_gamma   60.64
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Y2PdRu
_chemical_formula_sum   'Y2 Pd1 Ru1'
_cell_volume   82.67
_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  0.34  0.4  0.25  1.0
  Y  Y1  1  0.75  -0.0  0.71  1.0
  Ru  Ru2  1  0.0  0.0  0.0  1.0
  Pd  Pd3  1  0.5  0.0  0.5  1.0

Y Y Pd Ru