data_CoRu2Pb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.62
_cell_length_b   4.62
_cell_length_c   4.99
_cell_angle_alpha   101.01
_cell_angle_beta   101.01
_cell_angle_gamma   37.13
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoRu2Pb
_chemical_formula_sum   'Co1 Ru2 Pb1'
_cell_volume   63.04
_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
  Co  Co0  1  0.0  0.0  0.0  1.0
  Ru  Ru2  1  0.25  0.0  0.0  1.0
  Ru  Ru3  1  0.51  0.0  0.89  1.0
  Pb  Pb1  1  0.88  0.0  0.44  1.0

data_CoRu2Pb
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.94
_cell_length_b   4.62
_cell_length_c   4.99
_cell_angle_alpha   101.01
_cell_angle_beta   90.0
_cell_angle_gamma   108.56
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoRu2Pb
_chemical_formula_sum   'Co1 Ru2 Pb1'
_cell_volume   63.04
_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
  Co  Co0  1  0.0  0.0  0.0  1.0
  Ru  Ru1  1  0.0  0.49  0.11  1.0
  Ru  Ru2  1  0.0  0.75  1.0  1.0
  Pb  Pb3  1  0.0  0.12  0.56  1.0

Co Ru Ru Pb