data_[Zr8Pa4Ge8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zr  1.3300  1.5500  0.8600
  Pa  1.5000  1.8000  1.0400
  Ge  2.0100  1.2500  0.7700
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [9.3474]
_cell_length_b [10.8645]
_cell_length_c [5.4611]
_cell_angle_alpha [90.0000]
_cell_angle_beta [122.8196]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Zr2PaGe2]
_chemical_formula_sum '[Zr8 Pa4 Ge8]'
_cell_volume [466.0737]
_cell_formula_units_Z [4]
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
[
  Zr  Zr0  8  0.1835  0.0950  0.9755  1
  Pa  Pa1  4  0.0000  0.3934  0.2500  1
  Ge  Ge2  4  0.0000  0.1266  0.2500  1
  Ge  Ge3  4  0.0000  0.3122  0.7500  1
]