data_KAs2Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.37
_cell_length_b   5.37
_cell_length_c   5.37
_cell_angle_alpha   134.09
_cell_angle_beta   134.09
_cell_angle_gamma   66.94
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KAs2Ir
_chemical_formula_sum   'K1 As2 Ir1'
_cell_volume   78.57
_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  K3  1  0.0  0.0  0.0  1.0
  As  As0  1  0.09  0.0  0.24  1.0
  As  As1  1  0.0  0.0  0.48  1.0
  Ir  Ir2  1  0.0  0.09  0.24  1.0

data_KAs2Ir
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.19
_cell_length_b   4.19
_cell_length_c   5.37
_cell_angle_alpha   112.95
_cell_angle_beta   112.95
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KAs2Ir
_chemical_formula_sum   'K1 As2 Ir1'
_cell_volume   78.57
_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  0.0  0.0  1.0
  As  As1  1  0.52  0.0  0.52  1.0
  As  As2  1  0.76  0.0  0.85  1.0
  Ir  Ir3  1  0.85  0.09  0.85  1.0

K As As Ir