data_Cd2CoRu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.86
_cell_length_b   2.86
_cell_length_c   8.05
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd2CoRu
_chemical_formula_sum   'Cd2 Co1 Ru1'
_cell_volume   65.78
_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  0.0  0.82  1.0
  Cd  Cd1  1  0.43  0.43  0.33  1.0
  Co  Co2  1  0.0  0.0  0.27  1.0
  Ru  Ru3  1  0.43  0.43  0.7  1.0

data_Cd2CoRu
_symmetry_space_group_name_H-M   Cm
_cell_length_a   4.04
_cell_length_b   4.04
_cell_length_c   8.05
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   Cd2CoRu
_chemical_formula_sum   'Cd4 Co2 Ru2'
_cell_volume   131.56
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  2  0.0  0.0  0.82  1.0
  Cd  Cd1  2  0.43  0.0  0.33  1.0
  Co  Co2  2  0.0  0.0  0.27  1.0
  Ru  Ru3  2  0.43  0.0  0.7  1.0

Cd Cd Co Ru
Cd Cd Co Ru 0 3 - - o 0 3 - o o 0 3 o - o 0 3 o o o 1 2 o o o 1 2 o + o 1 2 + o o 