data_Sc2RhAu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.9
_cell_length_b   3.9
_cell_length_c   6.88
_cell_angle_alpha   101.65
_cell_angle_beta   101.65
_cell_angle_gamma   52.11
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc2RhAu
_chemical_formula_sum   'Sc2 Rh1 Au1'
_cell_volume   80.58
_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  0.58  0.0  0.18  1.0
  Sc  Sc3  1  0.88  0.0  0.52  1.0
  Rh  Rh1  1  0.0  0.0  0.0  1.0
  Au  Au0  1  0.73  0.0  0.35  1.0

data_Sc2RhAu
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.43
_cell_length_b   3.9
_cell_length_c   6.88
_cell_angle_alpha   101.65
_cell_angle_beta   90.0
_cell_angle_gamma   116.05
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc2RhAu
_chemical_formula_sum   'Sc2 Rh1 Au1'
_cell_volume   80.58
_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  0.12  0.48  1.0
  Sc  Sc1  1  0.0  0.42  0.82  1.0
  Rh  Rh2  1  0.0  0.0  0.0  1.0
  Au  Au3  1  0.0  0.27  0.65  1.0

Sc Sc Rh Au