data_[Ac2U2Ag4S12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ac  1.1000  1.9500  1.2600
  U  1.3800  1.7500  0.9913
  Ag  1.9300  1.6000  1.0867
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [7.1047]
_cell_length_b [7.2160]
_cell_length_c [11.6427]
_cell_angle_alpha [90.0000]
_cell_angle_beta [120.6215]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [AcU(AgS3)2]
_chemical_formula_sum '[Ac2 U2 Ag4 S12]'
_cell_volume [513.6550]
_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
[
  Ac  Ac0  2  0.5000  0.0000  0.0000  1
  U  U1  2  0.0000  0.0000  0.5000  1
  Ag  Ag2  4  0.1410  0.1050  0.1676  1
  S  S3  4  0.0651  0.0679  0.7401  1
  S  S4  4  0.2304  0.7022  0.5863  1
  S  S5  4  0.3519  0.1798  0.5900  1
]