data_[Pa2Cr1Hg1O8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pa  1.5000  1.8000  1.0400
  Cr  1.6600  1.4000  0.9400
  Hg  2.0000  1.5000  1.2450
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P-3]
_cell_length_a [6.1639]
_cell_length_b [6.1639]
_cell_length_c [5.6156]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [147]
_chemical_formula_structural [Pa2CrHgO8]
_chemical_formula_sum '[Pa2 Cr1 Hg1 O8]'
_cell_volume [184.7702]
_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  0.3333  0.6667  0.9150  1
  Cr  Cr1  1  0.0000  0.0000  0.5000  1
  Hg  Hg2  1  0.0000  0.0000  0.0000  1
  O  O3  6  0.0545  0.3621  0.1707  1
  O  O4  2  0.3333  0.6667  0.5744  1
]