data_Cr3Re5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.22
_cell_length_b   7.22
_cell_length_c   4.98
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr3Re5
_chemical_formula_sum   'Cr6 Re10'
_cell_volume   224.69
_cell_formula_units_Z   2
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
  Cr  Cr0  1  0.51  0.58  0.25  1.0
  Cr  Cr1  1  0.88  0.67  0.74  1.0
  Cr  Cr2  1  0.98  0.0  0.25  1.0
  Cr  Cr3  1  0.49  0.58  0.74  1.0
  Cr  Cr4  1  0.23  0.0  0.74  1.0
  Cr  Cr5  1  0.12  0.67  0.25  1.0
  Re  Re6  1  0.16  0.45  0.74  1.0
  Re  Re7  1  0.23  0.8  0.25  1.0
  Re  Re8  1  0.68  0.0  0.74  1.0
  Re  Re9  1  0.84  0.45  0.25  1.0
  Re  Re10  1  0.0  0.17  0.49  1.0
  Re  Re11  1  0.0  0.17  0.0  1.0
  Re  Re12  1  0.61  0.08  0.49  1.0
  Re  Re13  1  0.61  0.08  0.0  1.0
  Re  Re14  1  0.54  0.0  0.25  1.0
  Re  Re15  1  0.77  0.8  0.74  1.0

data_Cr3Re5
_symmetry_space_group_name_H-M   Pm
_cell_length_a   7.22
_cell_length_b   4.98
_cell_length_c   7.22
_cell_angle_alpha   90.0
_cell_angle_beta   120.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   6
_chemical_formula_structural   Cr3Re5
_chemical_formula_sum   'Cr6 Re10'
_cell_volume   224.69
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '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
  Cr  Cr0  1  0.12  0.5  0.67  1.0
  Cr  Cr1  1  0.23  0.0  0.0  1.0
  Cr  Cr2  1  0.49  0.0  0.58  1.0
  Cr  Cr3  1  0.51  0.5  0.58  1.0
  Cr  Cr4  1  0.88  0.0  0.67  1.0
  Cr  Cr5  1  0.98  0.5  0.0  1.0
  Re  Re6  2  0.0  0.25  0.17  1.0
  Re  Re7  2  0.61  0.25  0.08  1.0
  Re  Re8  1  0.16  0.0  0.45  1.0
  Re  Re9  1  0.23  0.5  0.8  1.0
  Re  Re10  1  0.54  0.5  0.0  1.0
  Re  Re11  1  0.68  0.0  0.0  1.0
  Re  Re12  1  0.77  0.0  0.8  1.0
  Re  Re13  1  0.84  0.5  0.45  1.0

Cr Cr Cr Cr Cr Cr Re Re Re Re Re Re Re Re Re Re