[CIF]
data_Sc2NbIr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.77956718
_cell_length_b   4.77956718
_cell_length_c   3.19350711
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc2NbIr
_chemical_formula_sum   'Sc2 Nb1 Ir1'
_cell_volume   72.95331457
_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
  Ir  Ir0  1  2.38978359  2.38978359  0.00000000  1
  Nb  Nb1  1  0.00000000  0.00000000  0.00000000  1
  Sc  Sc2  1  0.00000000  2.38978359  1.59675356  1
  Sc  Sc3  1  2.38978359  0.00000000  1.59675356  1
[/CIF]
