data_CdRe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.13
_cell_length_b   5.13
_cell_length_c   5.13
_cell_angle_alpha   147.62
_cell_angle_beta   135.85
_cell_angle_gamma   55.8
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CdRe2
_chemical_formula_sum   'Cd1 Re2'
_cell_volume   49.93
_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  0.0  1.0
  Re  Re1  1  0.0  0.0  0.21  1.0
  Re  Re2  1  0.0  0.0  0.85  1.0

data_CdRe2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.86
_cell_length_b   3.85
_cell_length_c   5.13
_cell_angle_alpha   112.07
_cell_angle_beta   106.19
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CdRe2
_chemical_formula_sum   'Cd1 Re2'
_cell_volume   49.93
_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  0.0  1.0
  Re  Re1  1  0.0  0.21  0.21  1.0
  Re  Re2  1  0.0  0.85  0.85  1.0

Cd Re Re