data_KPdRu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.73
_cell_length_b   4.74
_cell_length_c   6.56
_cell_angle_alpha   90.0
_cell_angle_beta   101.93
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KPdRu2
_chemical_formula_sum   'K1 Pd1 Ru2'
_cell_volume   83.04
_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
  K  K0  1  0.0  0.0  0.0  1.0
  Pd  Pd1  1  0.32  0.0  0.21  1.0
  Ru  Ru2  1  0.07  0.37  0.25  1.0
  Ru  Ru3  1  0.3  0.37  0.17  1.0

data_KPdRu2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.73
_cell_length_b   4.74
_cell_length_c   6.56
_cell_angle_alpha   90.0
_cell_angle_beta   101.93
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KPdRu2
_chemical_formula_sum   'K1 Pd1 Ru2'
_cell_volume   83.04
_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
  K  K0  1  0.0  0.0  0.0  1.0
  Ru  Ru1  1  0.07  0.37  0.25  1.0
  Ru  Ru2  1  0.3  0.37  0.17  1.0
  Pd  Pd3  1  0.32  0.0  0.21  1.0

K Pd Ru Ru
K Pd Ru Ru 0 1 o o o 1 3 o o o 2 3 o o o 