data_PRu2Rh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.87
_cell_length_b   3.81
_cell_length_c   5.17
_cell_angle_alpha   90.0
_cell_angle_beta   104.5
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   PRu2Rh
_chemical_formula_sum   'P1 Ru2 Rh1'
_cell_volume   54.7
_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  0.0  0.0  1.0
  Ru  Ru2  1  0.83  0.91  0.83  1.0
  Ru  Ru3  1  0.74  0.91  0.17  1.0
  Rh  Rh1  1  0.35  0.0  0.5  1.0

data_PRu2Rh
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.87
_cell_length_b   3.81
_cell_length_c   5.17
_cell_angle_alpha   90.0
_cell_angle_beta   104.5
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   PRu2Rh
_chemical_formula_sum   'P1 Ru2 Rh1'
_cell_volume   54.7
_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  0.0  0.0  1.0
  Ru  Ru1  1  0.74  0.91  0.17  1.0
  Ru  Ru2  1  0.83  0.91  0.83  1.0
  Rh  Rh3  1  0.35  0.0  0.5  1.0

P Ru Ru Rh