data_ScCuRh2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.89
_cell_length_b   4.89
_cell_length_c   4.89
_cell_angle_alpha   133.53
_cell_angle_beta   133.53
_cell_angle_gamma   67.82
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScCuRh2
_chemical_formula_sum   'Sc1 Cu1 Rh2'
_cell_volume   60.25
_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  Sc3  1  0.0  0.0  0.0  1.0
  Cu  Cu0  1  0.0  0.93  0.03  1.0
  Rh  Rh1  1  0.0  0.0  0.05  1.0
  Rh  Rh2  1  0.93  0.0  0.03  1.0

data_ScCuRh2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.85
_cell_length_b   3.85
_cell_length_c   4.89
_cell_angle_alpha   113.23
_cell_angle_beta   113.23
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScCuRh2
_chemical_formula_sum   'Sc1 Cu1 Rh2'
_cell_volume   60.25
_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  Sc0  1  0.0  0.0  0.0  1.0
  Cu  Cu1  1  0.9  0.93  0.9  1.0
  Rh  Rh2  1  0.95  0.0  0.95  1.0
  Rh  Rh3  1  0.97  0.0  0.9  1.0

Sc Cu Rh Rh