data_[Th6Zn4Os4C6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Th  1.3000  1.8000  1.0800
  Zn  1.6500  1.3500  0.8800
  Os  2.2000  1.3000  0.6730
  C  2.5500  0.7000  0.3000
]
_symmetry_space_group_name_H-M [I4/mmm]
_cell_length_a [3.8803]
_cell_length_b [3.8803]
_cell_length_c [24.2682]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [139]
_chemical_formula_structural [Th3Zn2Os2C3]
_chemical_formula_sum '[Th6 Zn4 Os4 C6]'
_cell_volume [365.4034]
_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  4  0.0000  0.0000  0.3872  1
  Th  Th1  2  0.0000  0.0000  0.0000  1
  Zn  Zn2  4  0.0000  0.5000  0.2500  1
  Os  Os3  4  0.0000  0.0000  0.1793  1
  C  C4  4  0.0000  0.0000  0.1017  1
  C  C5  2  0.0000  0.0000  0.5000  1
]