data_Sc2RuRh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.03
_cell_length_b   4.29
_cell_length_c   5.37
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc2RuRh
_chemical_formula_sum   'Sc2 Ru1 Rh1'
_cell_volume   69.82
_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
  Sc  Sc2  1  0.51  0.15  0.08  1.0
  Sc  Sc3  1  0.0  0.0  0.61  1.0
  Ru  Ru1  1  0.0  0.0  0.28  1.0
  Rh  Rh0  1  0.51  0.15  0.45  1.0

data_Sc2RuRh
_symmetry_space_group_name_H-M   Pm
_cell_length_a   4.29
_cell_length_b   3.03
_cell_length_c   5.37
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   6
_chemical_formula_structural   Sc2RuRh
_chemical_formula_sum   'Sc2 Ru1 Rh1'
_cell_volume   69.82
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '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
  Sc  Sc0  1  0.0  0.0  0.61  1.0
  Sc  Sc1  1  0.15  0.5  0.08  1.0
  Ru  Ru2  1  0.0  0.0  0.28  1.0
  Rh  Rh3  1  0.15  0.5  0.45  1.0

Sc Sc Ru Rh
Sc Sc Ru Rh 0 2 o o o 0 2 + o o 0 3 o o o 1 3 - o o 1 3 o o o 1 2 o o o 2 3 - o o 2 3 o o o 