data_CdNiRu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.65
_cell_length_b   4.65
_cell_length_c   4.89
_cell_angle_alpha   98.91
_cell_angle_beta   98.91
_cell_angle_gamma   34.52
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CdNiRu2
_chemical_formula_sum   'Cd1 Ni1 Ru2'
_cell_volume   59.23
_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
  Cd  Cd0  1  0.04  0.0  0.31  1.0
  Ni  Ni1  1  0.42  0.0  0.17  1.0
  Ru  Ru2  1  0.24  0.0  0.73  1.0
  Ru  Ru3  1  0.65  0.0  0.86  1.0

data_CdNiRu2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.76
_cell_length_b   4.65
_cell_length_c   4.89
_cell_angle_alpha   98.91
_cell_angle_beta   90.0
_cell_angle_gamma   107.26
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CdNiRu2
_chemical_formula_sum   'Cd1 Ni1 Ru2'
_cell_volume   59.23
_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
  Cd  Cd0  1  0.0  0.96  0.69  1.0
  Ni  Ni1  1  0.0  0.58  0.83  1.0
  Ru  Ru2  1  0.0  0.35  0.14  1.0
  Ru  Ru3  1  0.0  0.76  0.27  1.0

Cd Ni Ru Ru