data_ReSb2As
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.54
_cell_length_b   9.54
_cell_length_c   9.54
_cell_angle_alpha   19.73
_cell_angle_beta   19.73
_cell_angle_gamma   19.73
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ReSb2As
_chemical_formula_sum   'Re1 Sb2 As1'
_cell_volume   86.54
_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
  Re  Re1  1  0.0  0.0  0.85  1.0
  Sb  Sb2  1  0.0  0.0  0.6  1.0
  Sb  Sb3  1  0.0  0.0  0.16  1.0
  As  As0  1  0.0  0.0  0.52  1.0

data_ReSb2As
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.66
_cell_length_b   3.27
_cell_length_c   9.54
_cell_angle_alpha   90.0
_cell_angle_beta   101.41
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   ReSb2As
_chemical_formula_sum   'Re2 Sb4 As2'
_cell_volume   173.08
_cell_formula_units_Z   2
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  2  -0.0  0.0  0.15  1.0
  Sb  Sb1  2  -0.0  0.0  0.4  1.0
  Sb  Sb2  2  -0.0  0.0  0.84  1.0
  As  As3  2  -0.0  0.0  0.48  1.0

Re Sb Sb As