data_Li2SnRu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.92
_cell_length_b   4.92
_cell_length_c   4.74
_cell_angle_alpha   108.19
_cell_angle_beta   108.19
_cell_angle_gamma   37.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2SnRu
_chemical_formula_sum   'Li2 Sn1 Ru1'
_cell_volume   65.29
_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  0.57  0.0  0.22  1.0
  Li  Li1  1  0.91  0.0  0.49  1.0
  Sn  Sn3  1  0.63  0.0  0.4  1.0
  Ru  Ru2  1  0.01  0.0  0.07  1.0

data_Li2SnRu
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.13
_cell_length_b   4.74
_cell_length_c   4.92
_cell_angle_alpha   108.19
_cell_angle_beta   108.5
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2SnRu
_chemical_formula_sum   'Li2 Sn1 Ru1'
_cell_volume   65.29
_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  0.22  0.57  1.0
  Li  Li1  1  0.0  0.49  0.91  1.0
  Sn  Sn2  1  0.0  0.4  0.63  1.0
  Ru  Ru3  1  0.0  0.07  0.01  1.0

Li Li Sn Ru
Li Li Sn Ru 0 2 o o o 0 3 + o o 0 3 o o o 1 2 o o o 1 3 + o + 1 3 + o o 2 3 + o o 