data_[Th10Sb4H2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Th  1.3000  1.8000  1.0800
  Sb  2.0500  1.4500  0.8300
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [I4mm]
_cell_length_a [7.2503]
_cell_length_b [7.2503]
_cell_length_c [8.6198]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [107]
_chemical_formula_structural [Th5Sb2H]
_chemical_formula_sum '[Th10 Sb4 H2]'
_cell_volume [453.1106]
_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  8  0.2493  0.2493  0.0015  1
  Th  Th1  2  0.0000  0.0000  0.7450  1
  Sb  Sb2  4  0.0000  0.5000  0.2501  1
  H  H3  2  0.0000  0.0000  0.0260  1
]