data_YHfRu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.63
_cell_length_b   6.6
_cell_length_c   3.27
_cell_angle_alpha   76.06
_cell_angle_beta   75.29
_cell_angle_gamma   28.66
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YHfRu
_chemical_formula_sum   'Y1 Hf1 Ru1'
_cell_volume   66.38
_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  0.28  0.35  0.85  1.0
  Hf  Hf0  1  0.28  0.35  0.47  1.0
  Ru  Ru1  1  0.28  0.35  0.07  1.0

data_YHfRu
_symmetry_space_group_name_H-M   Imm2
_cell_length_a   3.27
_cell_length_b   12.39
_cell_length_c   3.27
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   44
_chemical_formula_structural   YHfRu
_chemical_formula_sum   'Y2 Hf2 Ru2'
_cell_volume   132.81
_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, y, z'
  4  'x, -y, z'
  5  'x+1/2, y+1/2, z+1/2'
  6  '-x+1/2, -y+1/2, z+1/2'
  7  '-x+1/2, y+1/2, z+1/2'
  8  'x+1/2, -y+1/2, z+1/2'
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  0.5  0.19  1.0
  Hf  Hf1  2  0.0  0.5  0.82  1.0
  Ru  Ru2  2  0.0  0.5  0.42  1.0

Y Hf Ru
Y Hf Ru 0 2 o o + 0 1 o o o 1 2 o o o 