data_[Pa2Rh2Au8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pa  1.5000  1.8000  1.0400
  Rh  2.2800  1.3500  0.7450
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [5.4510]
_cell_length_b [9.1106]
_cell_length_c [5.3116]
_cell_angle_alpha [90.0000]
_cell_angle_beta [118.0675]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [PaRhAu4]
_chemical_formula_sum '[Pa2 Rh2 Au8]'
_cell_volume [232.7624]
_cell_formula_units_Z [2]
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  0.0529  0.5000  0.0640  1
  Rh  Rh1  2  0.4912  0.5000  0.4706  1
  Au  Au2  4  0.0062  0.1597  0.9727  1
  Au  Au3  4  0.4662  0.8260  0.5061  1
]