[CIF]
data_Sc2CuRu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.24827365
_cell_length_b   3.24827365
_cell_length_c   6.47124233
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc2CuRu
_chemical_formula_sum   'Sc2 Cu1 Ru1'
_cell_volume   68.27990081
_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
  Cu  Cu0  1  0.00000000  0.00000000  0.00000000  1
  Ru  Ru1  1  0.00000000  0.00000000  3.23562116  1
  Sc  Sc2  1  1.62413683  1.62413683  4.78536936  1
  Sc  Sc3  1  1.62413683  1.62413683  1.68587297  1
[/CIF]
