data_SrSnRu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.99
_cell_length_b   5.99
_cell_length_c   5.99
_cell_angle_alpha   149.78
_cell_angle_beta   132.27
_cell_angle_gamma   57.54
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrSnRu2
_chemical_formula_sum   'Sr1 Sn1 Ru2'
_cell_volume   79.61
_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
  Sr  Sr3  1  0.0  0.0  0.92  1.0
  Sn  Sn2  1  0.56  0.0  0.92  1.0
  Ru  Ru0  1  0.56  0.0  0.37  1.0
  Ru  Ru1  1  0.0  0.0  0.55  1.0

data_SrSnRu2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.12
_cell_length_b   4.85
_cell_length_c   5.99
_cell_angle_alpha   113.87
_cell_angle_beta   105.11
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrSnRu2
_chemical_formula_sum   'Sr1 Sn1 Ru2'
_cell_volume   79.61
_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
  Sr  Sr0  1  0.08  0.08  0.08  1.0
  Sn  Sn1  1  0.64  0.08  0.64  1.0
  Ru  Ru2  1  0.19  0.63  0.19  1.0
  Ru  Ru3  1  0.45  0.45  0.45  1.0

Sr Sn Ru Ru
Sr Sn Ru Ru 0 2 - o o 0 2 o o + 0 1 - o o 0 3 o o o 1 1 o + + 1 3 o o o 1 3 + o + 1 2 o o + 2 3 + o o 