data_BeRe2Sb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.0
_cell_length_b   3.82
_cell_length_c   5.47
_cell_angle_alpha   90.0
_cell_angle_beta   104.09
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BeRe2Sb
_chemical_formula_sum   'Be1 Re2 Sb1'
_cell_volume   60.74
_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
  Be  Be0  1  0.0  0.0  0.0  1.0
  Re  Re1  1  0.8  0.91  0.1  1.0
  Re  Re2  1  0.87  0.91  0.2  1.0
  Sb  Sb3  1  0.33  0.0  0.65  1.0

data_BeRe2Sb
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.0
_cell_length_b   3.82
_cell_length_c   5.47
_cell_angle_alpha   90.0
_cell_angle_beta   104.09
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BeRe2Sb
_chemical_formula_sum   'Be1 Re2 Sb1'
_cell_volume   60.74
_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
  Be  Be0  1  0.0  0.0  0.0  1.0
  Re  Re1  1  0.8  0.91  0.1  1.0
  Re  Re2  1  0.87  0.91  0.2  1.0
  Sb  Sb3  1  0.33  0.0  0.65  1.0

Be Re Re Sb