data_[Th24Tc8Ag4]
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
  Ag  1.9300  1.6000  1.0867
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [9.3701]
_cell_length_b [9.6806]
_cell_length_c [10.9050]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [Th6Tc2Ag]
_chemical_formula_sum '[Th24 Tc8 Ag4]'
_cell_volume [989.1707]
_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  0.1994  0.2358  1
  Th  Th1  8  0.1955  0.5000  0.1665  1
  Th  Th2  8  0.2050  0.3194  0.5000  1
  Tc  Tc3  4  0.0000  0.3270  0.0000  1
  Tc  Tc4  4  0.0000  0.5000  0.3612  1
  Ag  Ag5  2  0.0000  0.0000  0.0000  1
  Ag  Ag6  2  0.0000  0.0000  0.5000  1
]