data_[Pa2Tc2Br4O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pa  1.5000  1.8000  1.0400
  Tc  1.9000  1.3500  0.7417
  Br  2.9600  1.1500  0.8825
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [5.4474]
_cell_length_b [6.2483]
_cell_length_c [8.3336]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [PaTc(BrO3)2]
_chemical_formula_sum '[Pa2 Tc2 Br4 O12]'
_cell_volume [283.6455]
_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  0.0000  0.5000  0.0000  1
  Tc  Tc1  2  0.0000  0.5000  0.5000  1
  Br  Br2  4  0.0000  0.0000  0.2750  1
  O  O3  8  0.2419  0.2821  0.5000  1
  O  O4  4  0.0000  0.5000  0.2675  1
]