data_ZrCdRe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.21
_cell_length_b   5.21
_cell_length_c   5.21
_cell_angle_alpha   149.16
_cell_angle_beta   128.69
_cell_angle_gamma   61.07
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrCdRe
_chemical_formula_sum   'Zr1 Cd1 Re1'
_cell_volume   56.2
_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
  Zr  Zr2  1  0.0  0.0  0.97  1.0
  Cd  Cd0  1  0.0  0.0  0.04  1.0
  Re  Re1  1  0.0  0.0  0.98  1.0

data_ZrCdRe
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.77
_cell_length_b   4.51
_cell_length_c   5.21
_cell_angle_alpha   115.65
_cell_angle_beta   105.42
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrCdRe
_chemical_formula_sum   'Zr1 Cd1 Re1'
_cell_volume   56.2
_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
  Zr  Zr0  1  0.03  0.03  0.03  1.0
  Cd  Cd1  1  0.96  0.96  0.96  1.0
  Re  Re2  1  0.02  0.02  0.02  1.0

Zr Cd Re
Zr Cd Re 0 2 o o o 0 1 o o + 1 2 o o - 