data_KAgIr2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.71
_cell_length_b   2.71
_cell_length_c   9.99
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KAgIr2
_chemical_formula_sum   'K1 Ag1 Ir2'
_cell_volume   73.46
_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  K3  1  0.0  0.0  0.0  1.0
  Ag  Ag0  1  0.0  0.0  1.0  1.0
  Ir  Ir1  1  0.36  0.36  0.23  1.0
  Ir  Ir2  1  0.36  0.36  0.76  1.0

data_KAgIr2
_symmetry_space_group_name_H-M   Amm2
_cell_length_a   9.99
_cell_length_b   3.83
_cell_length_c   3.83
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   38
_chemical_formula_structural   KAgIr2
_chemical_formula_sum   'K2 Ag2 Ir4'
_cell_volume   146.92
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-x, -y, z'
  3  '-x, y, z'
  4  'x, -y, z'
  5  'x, y+1/2, z+1/2'
  6  '-x, -y+1/2, z+1/2'
  7  '-x, y+1/2, z+1/2'
  8  'x, -y+1/2, z+1/2'
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  2  0.0  0.0  0.0  1.0
  Ag  Ag1  2  0.0  0.0  0.0  1.0
  Ir  Ir2  4  0.23  0.0  0.36  1.0

K Ag Ir Ir 0 1 o o - 0 2 o o o 0 2 o - o 0 2 - o o 0 3 o o - 0 3 o - - 0 3 - o - 1 2 o o + 1 2 o - + 1 2 - o + 1 3 o o o 1 3 o - o 1 3 - o o 2 2 + o o 2 2 o + o 3 3 + o o 3 3 o + o 