data_ReTeAu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.41
_cell_length_b   10.41
_cell_length_c   10.41
_cell_angle_alpha   16.41
_cell_angle_beta   16.41
_cell_angle_gamma   16.41
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ReTeAu2
_chemical_formula_sum   'Re1 Te1 Au2'
_cell_volume   78.47
_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  Re2  1  0.0  0.0  0.4  1.0
  Te  Te3  1  0.0  0.0  0.0  1.0
  Au  Au0  1  0.0  0.0  0.44  1.0
  Au  Au1  1  0.0  0.0  0.36  1.0

data_ReTeAu2
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.15
_cell_length_b   2.97
_cell_length_c   10.41
_cell_angle_alpha   90.0
_cell_angle_beta   99.49
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   ReTeAu2
_chemical_formula_sum   'Re2 Te2 Au4'
_cell_volume   156.93
_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  0.6  1.0
  Te  Te1  2  0.0  0.0  0.0  1.0
  Au  Au2  2  0.0  0.0  0.56  1.0
  Au  Au3  2  0.0  0.0  0.64  1.0

Re Te Au Au