data_[Pa6Os2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pa  1.5000  1.8000  1.0400
  Os  2.2000  1.3000  0.6730
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [6.3699]
_cell_length_b [3.5058]
_cell_length_c [8.5171]
_cell_angle_alpha [90.0000]
_cell_angle_beta [99.4791]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Pa3Os]
_chemical_formula_sum '[Pa6 Os2]'
_cell_volume [187.6064]
_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  0.0570  0.2500  0.8364  1
  Pa  Pa1  2  0.2201  0.2500  0.4471  1
  Pa  Pa2  2  0.3787  0.7500  0.1177  1
  Os  Os3  2  0.3403  0.7500  0.7000  1
]