data_[Pa3P4Ru2Rh2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pa  1.5000  1.8000  1.0400
  P  2.1900  1.0000  0.5500
  Ru  2.2000  1.3000  0.6610
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [P-3m1]
_cell_length_a [4.0495]
_cell_length_b [4.0495]
_cell_length_c [13.9184]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [164]
_chemical_formula_structural [Pa3P4(RuRh)2]
_chemical_formula_sum '[Pa3 P4 Ru2 Rh2]'
_cell_volume [197.6566]
_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
[
  Pa  Pa0  2  0.0000  0.0000  0.2692  1
  Pa  Pa1  1  0.0000  0.0000  0.0000  1
  P  P2  2  0.3333  0.6667  0.3952  1
  P  P3  2  0.3333  0.6667  0.8744  1
  Ru  Ru4  2  0.3333  0.6667  0.1512  1
  Rh  Rh5  2  0.3333  0.6667  0.5658  1
]