data_P2IrAu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.9
_cell_length_b   5.9
_cell_length_c   5.9
_cell_angle_alpha   152.3
_cell_angle_beta   132.64
_cell_angle_gamma   55.76
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P2IrAu
_chemical_formula_sum   'P2 Ir1 Au1'
_cell_volume   69.78
_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
  P  P2  1  0.0  0.37  0.25  1.0
  P  P3  1  0.41  0.0  0.96  1.0
  Ir  Ir1  1  0.0  0.0  0.0  1.0
  Au  Au0  1  0.0  0.0  0.21  1.0

data_P2IrAu
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.82
_cell_length_b   4.74
_cell_length_c   5.9
_cell_angle_alpha   113.68
_cell_angle_beta   103.85
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P2IrAu
_chemical_formula_sum   'P2 Ir1 Au1'
_cell_volume   69.78
_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
  P  P0  1  0.0  0.96  0.55  1.0
  P  P1  1  0.63  0.88  0.88  1.0
  Ir  Ir2  1  0.0  0.0  0.0  1.0
  Au  Au3  1  0.0  0.21  0.21  1.0

P P Ir Au