data_TeRhAu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.41
_cell_length_b   6.39
_cell_length_c   3.19
_cell_angle_alpha   75.92
_cell_angle_beta   75.23
_cell_angle_gamma   28.85
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TeRhAu
_chemical_formula_sum   'Te1 Rh1 Au1'
_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
  Te  Te2  1  0.22  0.28  0.38  1.0
  Rh  Rh1  1  0.22  0.28  0.86  1.0
  Au  Au0  1  0.22  0.28  0.7  1.0

data_TeRhAu
_symmetry_space_group_name_H-M   Imm2
_cell_length_a   3.19
_cell_length_b   11.97
_cell_length_c   3.19
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   44
_chemical_formula_structural   TeRhAu
_chemical_formula_sum   'Te2 Rh2 Au2'
_cell_volume   121.52
_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, y, z'
  4  'x, -y, z'
  5  'x+1/2, y+1/2, z+1/2'
  6  '-x+1/2, -y+1/2, z+1/2'
  7  '-x+1/2, y+1/2, z+1/2'
  8  'x+1/2, -y+1/2, z+1/2'
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
  Te  Te0  2  0.0  0.0  0.34  1.0
  Rh  Rh1  2  0.0  0.0  0.86  1.0
  Au  Au2  2  0.0  0.0  0.02  1.0

Te Rh Au