data_Li2AgRu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.37
_cell_length_b   5.37
_cell_length_c   5.37
_cell_angle_alpha   151.39
_cell_angle_beta   125.67
_cell_angle_gamma   62.54
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2AgRu
_chemical_formula_sum   'Li2 Ag1 Ru1'
_cell_volume   59.8
_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  Li1  1  0.33  0.0  0.3  1.0
  Li  Li2  1  0.0  0.45  0.29  1.0
  Ag  Ag0  1  0.0  0.0  0.59  1.0
  Ru  Ru3  1  0.0  0.0  0.0  1.0

data_Li2AgRu
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.65
_cell_length_b   4.91
_cell_length_c   5.37
_cell_angle_alpha   117.16
_cell_angle_beta   104.31
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2AgRu
_chemical_formula_sum   'Li2 Ag1 Ru1'
_cell_volume   59.8
_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  0.03  0.7  0.03  1.0
  Li  Li1  1  0.71  0.16  0.16  1.0
  Ag  Ag2  1  0.41  0.41  0.41  1.0
  Ru  Ru3  1  0.0  0.0  0.0  1.0

Li Li Ag Ru