data_IrPdW
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.83
_cell_length_b   4.83
_cell_length_c   4.83
_cell_angle_alpha   146.49
_cell_angle_beta   132.23
_cell_angle_gamma   59.61
_symmetry_Int_Tables_number   1
_chemical_formula_structural   IrPdW
_chemical_formula_sum   'Ir1 Pd1 W1'
_cell_volume   45.57
_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
  Ir  Ir0  1  0.0  0.0  0.33  1.0
  Pd  Pd1  1  0.0  0.0  0.59  1.0
  W  W2  1  0.0  0.0  0.84  1.0

data_IrPdW
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.78
_cell_length_b   3.91
_cell_length_c   4.83
_cell_angle_alpha   113.88
_cell_angle_beta   106.75
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   IrPdW
_chemical_formula_sum   'Ir1 Pd1 W1'
_cell_volume   45.57
_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
  Pd  Pd0  1  0.41  0.41  0.41  1.0
  Ir  Ir1  1  0.67  0.67  0.67  1.0
  W  W2  1  0.16  0.16  0.16  1.0

Ir Pd W
Ir Pd W 0 1 o o o 1 2 o o o 