data_[Th16H4Au4C8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Th  1.3000  1.8000  1.0800
  H  2.2000  0.2500  0.0000
  Au  2.5400  1.3500  1.0700
  C  2.5500  0.7000  0.3000
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [3.8273]
_cell_length_b [12.6613]
_cell_length_c [13.6996]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [Th4HAuC2]
_chemical_formula_sum '[Th16 H4 Au4 C8]'
_cell_volume [663.8562]
_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
[
  Th  Th0  8  0.0000  0.2680  0.1032  1
  Th  Th1  4  0.0000  0.0000  0.0000  1
  Th  Th2  4  0.0000  0.4323  0.7500  1
  H  H3  4  0.0000  0.1683  0.2500  1
  Au  Au4  4  0.0000  0.1200  0.7500  1
  C  C5  8  0.0000  0.3690  0.5667  1
]