data_Cd2ReOs
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.88
_cell_length_b   3.59
_cell_length_c   7.02
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd2ReOs
_chemical_formula_sum   'Cd2 Re1 Os1'
_cell_volume   72.4
_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  0.44  0.79  0.88  1.0
  Cd  Cd1  1  0.0  0.0  0.91  1.0
  Re  Re3  1  0.0  0.0  0.97  1.0
  Os  Os2  1  0.44  0.79  0.78  1.0

data_Cd2ReOs
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.88
_cell_length_b   3.59
_cell_length_c   7.02
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd2ReOs
_chemical_formula_sum   'Cd2 Re1 Os1'
_cell_volume   72.4
_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  0.91  1.0
  Cd  Cd1  1  0.44  0.79  0.88  1.0
  Re  Re2  1  0.0  0.0  0.97  1.0
  Os  Os3  1  0.44  0.79  0.78  1.0

Cd Cd Re Os