data_[Th6Sb2Os2Ru2]
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
  Os  2.2000  1.3000  0.6730
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [8.3797]
_cell_length_b [4.3138]
_cell_length_c [9.9266]
_cell_angle_alpha [90.0000]
_cell_angle_beta [114.7207]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Th3SbOsRu]
_chemical_formula_sum '[Th6 Sb2 Os2 Ru2]'
_cell_volume [325.9446]
_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  2  0.2012  0.7500  0.1303  1
  Th  Th1  2  0.2642  0.7500  0.5240  1
  Th  Th2  2  0.3419  0.2500  0.8571  1
  Sb  Sb3  2  0.0059  0.7500  0.7288  1
  Os  Os4  2  0.4359  0.2500  0.1636  1
  Ru  Ru5  2  0.4901  0.7500  0.3897  1
]