data_[U10Cu4S24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  U  1.3800  1.7500  0.9913
  Cu  1.9000  1.3500  0.8200
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [14.9016]
_cell_length_b [6.8413]
_cell_length_c [8.4320]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.3268]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [U5(CuS6)2]
_chemical_formula_sum '[U10 Cu4 S24]'
_cell_volume [824.9469]
_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
[
  U  U0  4  0.1806  0.5000  0.8481  1
  U  U1  4  0.1917  0.5000  0.3433  1
  U  U2  2  0.0000  0.0000  0.5000  1
  Cu  Cu3  4  0.0000  0.2643  0.0000  1
  S  S4  8  0.1528  0.2485  0.5718  1
  S  S5  8  0.1696  0.2498  0.0914  1
  S  S6  4  0.0023  0.5000  0.2279  1
  S  S7  4  0.0040  0.0000  0.7908  1
]