data_PtRh3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.47
_cell_length_b   5.47
_cell_length_c   13.45
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   PtRh3
_chemical_formula_sum   'Pt6 Rh18'
_cell_volume   349.05
_cell_formula_units_Z   6
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  0.0  0.0  0.09  1.0
  Pt  Pt1  1  0.0  0.0  0.36  1.0
  Pt  Pt2  1  0.0  0.16  0.11  1.0
  Pt  Pt3  1  0.0  0.16  0.61  1.0
  Pt  Pt4  1  0.74  0.58  0.34  1.0
  Pt  Pt5  1  0.74  0.58  0.84  1.0
  Rh  Rh6  1  0.63  0.37  0.09  1.0
  Rh  Rh7  1  0.1  0.37  0.36  1.0
  Rh  Rh8  1  0.0  0.58  0.34  1.0
  Rh  Rh9  1  0.0  0.58  0.84  1.0
  Rh  Rh10  1  0.63  0.95  0.34  1.0
  Rh  Rh11  1  0.63  0.95  0.84  1.0
  Rh  Rh12  1  0.37  0.79  0.11  1.0
  Rh  Rh13  1  0.37  0.79  0.61  1.0
  Rh  Rh14  1  0.0  0.74  0.09  1.0
  Rh  Rh15  1  0.74  0.0  0.36  1.0
  Rh  Rh16  1  0.37  0.37  0.09  1.0
  Rh  Rh17  1  0.37  0.37  0.36  1.0
  Rh  Rh18  1  0.37  0.95  0.34  1.0
  Rh  Rh19  1  0.37  0.95  0.84  1.0
  Rh  Rh20  1  0.1  0.79  0.11  1.0
  Rh  Rh21  1  0.1  0.79  0.61  1.0
  Rh  Rh22  1  0.74  0.16  0.11  1.0
  Rh  Rh23  1  0.74  0.16  0.61  1.0

data_PtRh3
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.47
_cell_length_b   5.47
_cell_length_c   13.45
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   PtRh3
_chemical_formula_sum   'Pt6 Rh18'
_cell_volume   349.05
_cell_formula_units_Z   6
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  0.0  0.0  0.09  1.0
  Pt  Pt1  1  0.0  0.0  0.36  1.0
  Rh  Rh2  1  0.0  0.58  0.34  1.0
  Rh  Rh3  1  0.0  0.58  0.84  1.0
  Pt  Pt4  1  0.0  0.16  0.11  1.0
  Pt  Pt5  1  0.0  0.16  0.61  1.0
  Rh  Rh6  1  0.0  0.74  0.09  1.0
  Rh  Rh7  1  0.1  0.37  0.36  1.0
  Rh  Rh8  1  0.1  0.79  0.11  1.0
  Rh  Rh9  1  0.1  0.79  0.61  1.0
  Rh  Rh10  1  0.37  0.37  0.09  1.0
  Rh  Rh11  1  0.37  0.95  0.34  1.0
  Rh  Rh12  1  0.37  0.95  0.84  1.0
  Rh  Rh13  1  0.37  0.79  0.11  1.0
  Rh  Rh14  1  0.37  0.79  0.61  1.0
  Rh  Rh15  1  0.37  0.37  0.36  1.0
  Rh  Rh16  1  0.63  0.95  0.34  1.0
  Rh  Rh17  1  0.63  0.95  0.84  1.0
  Rh  Rh18  1  0.63  0.37  0.09  1.0
  Rh  Rh19  1  0.74  0.0  0.36  1.0
  Rh  Rh20  1  0.74  0.16  0.11  1.0
  Rh  Rh21  1  0.74  0.16  0.61  1.0
  Pt  Pt22  1  0.74  0.58  0.34  1.0
  Pt  Pt23  1  0.74  0.58  0.84  1.0

Pt Pt Pt Pt Pt Pt Rh Rh Rh Rh Rh Rh Rh Rh Rh Rh Rh Rh Rh Rh Rh Rh Rh Rh
Pt Pt Pt Pt Pt Pt Rh Rh Rh Rh Rh Rh Rh Rh Rh Rh Rh Rh Rh Rh Rh Rh Rh Rh 0 2 o o o 1 15 - o o 2 16 o o o 2 22 - o o 3 23 - o o 4 8 + o o 4 17 o o o 5 9 + o o 6 16 o o o 6 22 o o o 7 8 o o o 7 17 o o o 10 15 o + o 10 18 o o o 11 19 o o o 12 20 o o o 13 21 o o o 14 20 o o o 