data_Re3Bi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.04
_cell_length_b   9.04
_cell_length_c   9.04
_cell_angle_alpha   153.87
_cell_angle_beta   153.87
_cell_angle_gamma   37.3
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Re3Bi
_chemical_formula_sum   'Re6 Bi2'
_cell_volume   143.21
_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
  Re  Re2  1  0.0  0.04  0.0  1.0
  Re  Re3  1  0.04  0.0  0.0  1.0
  Re  Re4  1  0.04  0.0  0.28  1.0
  Re  Re5  1  0.0  0.04  0.28  1.0
  Re  Re6  1  0.0  0.0  0.53  1.0
  Re  Re7  1  0.0  0.0  0.61  1.0
  Bi  Bi0  1  0.0  0.0  0.55  1.0
  Bi  Bi1  1  0.0  0.0  0.59  1.0

data_Re3Bi
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.78
_cell_length_b   5.78
_cell_length_c   9.04
_cell_angle_alpha   90.0
_cell_angle_beta   108.65
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   Re3Bi
_chemical_formula_sum   'Re12 Bi4'
_cell_volume   286.41
_cell_formula_units_Z   4
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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
  Re  Re0  4  0.02  0.02  0.76  1.0
  Re  Re1  4  0.02  0.02  0.04  1.0
  Re  Re2  2  0.0  0.0  0.39  1.0
  Re  Re3  2  0.0  0.0  0.47  1.0
  Bi  Bi4  2  0.0  0.0  0.41  1.0
  Bi  Bi5  2  0.0  0.0  0.45  1.0

Re Re Re Re Re Re Bi Bi