data_Si2TeRh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.08
_cell_length_b   3.08
_cell_length_c   7.98
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   92.58
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Si2TeRh
_chemical_formula_sum   'Si2 Te1 Rh1'
_cell_volume   75.57
_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
  Si  Si1  1  0.13  0.0  0.21  1.0
  Si  Si2  1  0.0  0.0  0.73  1.0
  Te  Te3  1  0.13  0.0  0.64  1.0
  Rh  Rh0  1  0.0  0.0  0.4  1.0

data_Si2TeRh
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.08
_cell_length_b   3.08
_cell_length_c   7.98
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   92.58
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Si2TeRh
_chemical_formula_sum   'Si2 Te1 Rh1'
_cell_volume   75.57
_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
  Si  Si0  1  0.0  0.0  0.73  1.0
  Si  Si1  1  0.13  0.0  0.21  1.0
  Te  Te2  1  0.13  0.0  0.64  1.0
  Rh  Rh3  1  0.0  0.0  0.4  1.0

Si Si Te Rh
Si Si Te Rh 0 3 o o o 1 2 o o o 