data_LiPdRu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.68
_cell_length_b   3.97
_cell_length_c   5.32
_cell_angle_alpha   90.0
_cell_angle_beta   101.22
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiPdRu2
_chemical_formula_sum   'Li1 Pd1 Ru2'
_cell_volume   55.58
_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
  Li  Li0  1  0.97  0.0  0.73  1.0
  Pd  Pd1  1  0.4  0.98  0.73  1.0
  Ru  Ru2  1  0.06  0.0  0.19  1.0
  Ru  Ru3  1  0.39  0.98  0.19  1.0

data_LiPdRu2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.68
_cell_length_b   3.97
_cell_length_c   5.32
_cell_angle_alpha   90.0
_cell_angle_beta   101.22
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiPdRu2
_chemical_formula_sum   'Li1 Pd1 Ru2'
_cell_volume   55.58
_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
  Li  Li0  1  0.97  0.0  0.73  1.0
  Ru  Ru1  1  0.06  0.0  0.19  1.0
  Ru  Ru2  1  0.39  0.98  0.19  1.0
  Pd  Pd3  1  0.4  0.98  0.73  1.0

Li Pd Ru Ru
Li Pd Ru Ru 0 1 + - o 2 3 o - o 