data_TeRh5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.86
_cell_length_b   4.86
_cell_length_c   4.5
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TeRh5
_chemical_formula_sum   'Te1 Rh5'
_cell_volume   91.85
_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  Te5  1  0.0  0.0  0.0  1.0
  Rh  Rh0  1  0.15  0.0  0.25  1.0
  Rh  Rh1  1  0.85  0.48  0.25  1.0
  Rh  Rh2  1  0.42  0.73  0.25  1.0
  Rh  Rh3  1  0.43  0.4  0.0  1.0
  Rh  Rh4  1  0.0  0.8  0.0  1.0

data_TeRh5
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.5
_cell_length_b   4.86
_cell_length_c   4.86
_cell_angle_alpha   120.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TeRh5
_chemical_formula_sum   'Te1 Rh5'
_cell_volume   91.85
_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  Te0  1  0.0  0.0  0.0  1.0
  Rh  Rh1  1  0.0  -0.0  0.8  1.0
  Rh  Rh2  1  0.0  0.43  0.4  1.0
  Rh  Rh3  1  0.25  0.15  0.0  1.0
  Rh  Rh4  1  0.25  0.42  0.73  1.0
  Rh  Rh5  1  0.25  0.85  0.48  1.0

Te Rh Rh Rh Rh Rh
Te Rh Rh Rh Rh Rh 0 5 o - o 0 1 o o o 0 4 o o o 1 5 o - o 1 2 - - o 1 3 o - o 1 4 o o o 2 4 o o o 2 5 + o o 2 3 + o o 3 4 o o o 