data_[Th2Pa8Ge10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Th  1.3000  1.8000  1.0800
  Pa  1.5000  1.8000  1.0400
  Ge  2.0100  1.2500  0.7700
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [4.1705]
_cell_length_b [5.8959]
_cell_length_c [20.8456]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [ThPa4Ge5]
_chemical_formula_sum '[Th2 Pa8 Ge10]'
_cell_volume [512.5703]
_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
[
  Th  Th0  2  0.0000  0.0000  0.0000  1
  Pa  Pa1  4  0.0000  0.0000  0.2017  1
  Pa  Pa2  4  0.0000  0.0000  0.3999  1
  Ge  Ge3  4  0.0000  0.5000  0.1991  1
  Ge  Ge4  4  0.0000  0.5000  0.3949  1
  Ge  Ge5  2  0.0000  0.5000  0.0000  1
]