data_K2CuIr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.4
_cell_length_b   6.4
_cell_length_c   6.08
_cell_angle_alpha   106.13
_cell_angle_beta   106.13
_cell_angle_gamma   24.9
_symmetry_Int_Tables_number   1
_chemical_formula_structural   K2CuIr
_chemical_formula_sum   'K2 Cu1 Ir1'
_cell_volume   100.57
_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
  K  K2  1  0.25  0.0  0.43  1.0
  K  K3  1  0.65  0.0  0.02  1.0
  Cu  Cu0  1  0.71  0.0  0.93  1.0
  Ir  Ir1  1  0.55  0.0  0.36  1.0

data_K2CuIr
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.76
_cell_length_b   6.08
_cell_length_c   6.4
_cell_angle_alpha   106.13
_cell_angle_beta   102.45
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   K2CuIr
_chemical_formula_sum   'K2 Cu1 Ir1'
_cell_volume   100.57
_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
  K  K0  1  0.0  0.02  0.65  1.0
  K  K1  1  0.0  0.43  0.25  1.0
  Cu  Cu2  1  0.0  0.93  0.71  1.0
  Ir  Ir3  1  0.0  0.36  0.55  1.0

K K Cu Ir