data_LiInRu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.85
_cell_length_b   4.85
_cell_length_c   4.85
_cell_angle_alpha   145.75
_cell_angle_beta   129.73
_cell_angle_gamma   62.25
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiInRu
_chemical_formula_sum   'Li1 In1 Ru1'
_cell_volume   48.75
_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  0.0  0.0  0.56  1.0
  In  In0  1  0.0  0.0  0.26  1.0
  Ru  Ru2  1  0.0  0.0  0.78  1.0

data_LiInRu
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.85
_cell_length_b   4.12
_cell_length_c   4.85
_cell_angle_alpha   115.14
_cell_angle_beta   107.13
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiInRu
_chemical_formula_sum   'Li1 In1 Ru1'
_cell_volume   48.75
_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  0.0  0.56  0.56  1.0
  In  In1  1  0.0  0.26  0.26  1.0
  Ru  Ru2  1  0.0  0.78  0.78  1.0

Li In Ru
Li In Ru 0 2 o o o 0 1 o o o 