data_CuSnRu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.86
_cell_length_b   4.37
_cell_length_c   5.0
_cell_angle_alpha   90.0
_cell_angle_beta   94.08
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CuSnRu2
_chemical_formula_sum   'Cu1 Sn1 Ru2'
_cell_volume   62.49
_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
  Cu  Cu0  1  0.0  0.0  0.0  1.0
  Sn  Sn3  1  0.25  0.0  0.5  1.0
  Ru  Ru1  1  0.06  0.18  0.12  1.0
  Ru  Ru2  1  0.45  0.18  0.87  1.0

data_CuSnRu2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.86
_cell_length_b   4.37
_cell_length_c   5.0
_cell_angle_alpha   90.0
_cell_angle_beta   94.08
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CuSnRu2
_chemical_formula_sum   'Cu1 Sn1 Ru2'
_cell_volume   62.49
_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
  Cu  Cu0  1  0.0  0.0  0.0  1.0
  Sn  Sn1  1  0.25  0.0  0.5  1.0
  Ru  Ru2  1  0.06  0.18  0.12  1.0
  Ru  Ru3  1  0.45  0.18  0.87  1.0

Cu Sn Ru Ru