data_[Th10Tc2Sb4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Th  1.3000  1.8000  1.0800
  Tc  1.9000  1.3500  0.7417
  Sb  2.0500  1.4500  0.8300
]
_symmetry_space_group_name_H-M [Pbam]
_cell_length_a [8.2257]
_cell_length_b [12.4685]
_cell_length_c [4.5901]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [55]
_chemical_formula_structural [Th5TcSb2]
_chemical_formula_sum '[Th10 Tc2 Sb4]'
_cell_volume [470.7756]
_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  0.1357  0.2957  0.0000  1
  Th  Th1  4  0.1959  0.5635  0.5000  1
  Th  Th2  2  0.0000  0.0000  0.0000  1
  Tc  Tc3  2  0.0000  0.5000  0.0000  1
  Sb  Sb4  4  0.0837  0.8249  0.5000  1
]