data_ReAg2Rh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.63
_cell_length_b   5.63
_cell_length_c   2.73
_cell_angle_alpha   103.06
_cell_angle_beta   103.06
_cell_angle_gamma   122.34
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ReAg2Rh
_chemical_formula_sum   'Re1 Ag2 Rh1'
_cell_volume   64.59
_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  0.72  0.0  0.0  1.0
  Ag  Ag0  1  0.72  0.47  0.21  1.0
  Ag  Ag1  1  0.72  0.53  0.21  1.0
  Rh  Rh3  1  0.0  0.0  0.0  1.0

data_ReAg2Rh
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.73
_cell_length_b   4.8
_cell_length_c   5.63
_cell_angle_alpha   114.64
_cell_angle_beta   103.06
_cell_angle_gamma   92.21
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ReAg2Rh
_chemical_formula_sum   'Re1 Ag2 Rh1'
_cell_volume   64.59
_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  Re0  1  0.0  0.0  0.72  1.0
  Ag  Ag1  1  0.67  0.47  0.18  1.0
  Ag  Ag2  1  0.74  0.53  0.25  1.0
  Rh  Rh3  1  0.0  0.0  0.0  1.0

Re Ag Ag Rh
Re Ag Ag Rh 0 3 + o o 1 2 o o o 