data_KRe2Rh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.22
_cell_length_b   5.22
_cell_length_c   2.93
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   111.15
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KRe2Rh
_chemical_formula_sum   'K1 Re2 Rh1'
_cell_volume   74.61
_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
  K  K0  1  0.0  0.0  0.0  1.0
  Re  Re1  1  0.48  0.15  0.47  1.0
  Re  Re2  1  0.48  0.85  0.47  1.0
  Rh  Rh3  1  0.95  0.0  0.0  1.0

data_KRe2Rh
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.93
_cell_length_b   5.22
_cell_length_c   5.22
_cell_angle_alpha   111.15
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KRe2Rh
_chemical_formula_sum   'K1 Re2 Rh1'
_cell_volume   74.61
_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
  K  K0  1  0.0  0.0  0.0  1.0
  Re  Re1  1  0.47  0.48  0.15  1.0
  Re  Re2  1  0.47  0.48  0.85  1.0
  Rh  Rh3  1  0.0  0.95  0.0  1.0

K Re Re Rh
K Re Re Rh 0 3 - o o 1 2 o - o 