data_PtRh2W
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.8
_cell_length_b   4.8
_cell_length_c   4.8
_cell_angle_alpha   132.16
_cell_angle_beta   132.16
_cell_angle_gamma   69.98
_symmetry_Int_Tables_number   1
_chemical_formula_structural   PtRh2W
_chemical_formula_sum   'Pt1 Rh2 W1'
_cell_volume   59.6
_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
  Pt  Pt0  1  0.95  0.0  0.97  1.0
  Rh  Rh1  1  0.0  0.0  0.0  1.0
  Rh  Rh2  1  0.0  0.95  0.97  1.0
  W  W3  1  0.0  0.0  0.93  1.0

data_PtRh2W
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.89
_cell_length_b   3.89
_cell_length_c   4.8
_cell_angle_alpha   113.92
_cell_angle_beta   113.92
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   PtRh2W
_chemical_formula_sum   'Pt1 Rh2 W1'
_cell_volume   59.6
_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
  Rh  Rh0  1  0.0  0.0  0.0  1.0
  Pt  Pt1  1  0.03  0.0  0.98  1.0
  Rh  Rh2  1  0.98  0.95  0.98  1.0
  W  W3  1  0.07  0.0  0.07  1.0

Pt Rh Rh W
Pt Rh Rh W 0 1 + o + 0 3 + o o 1 2 o - - 1 3 o o - 2 3 o + o 