data_[Th8Sn4Os4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Th  1.3000  1.8000  1.0800
  Sn  1.9600  1.4500  0.8300
  Os  2.2000  1.3000  0.6730
]
_symmetry_space_group_name_H-M [P2/c]
_cell_length_a [6.4670]
_cell_length_b [6.0511]
_cell_length_c [11.5748]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.5761]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [13]
_chemical_formula_structural [Th2SnOs]
_chemical_formula_sum '[Th8 Sn4 Os4]'
_cell_volume [438.3748]
_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  4  0.1655  0.3299  0.1214  1
  Th  Th1  4  0.2781  0.1580  0.8333  1
  Sn  Sn2  4  0.3524  0.3351  0.4237  1
  Os  Os3  4  0.1300  0.1713  0.5873  1
]