data_[Cu4Pb10Cl24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cu  1.9000  1.3500  0.8200
  Pb  2.3300  1.8000  1.1225
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.5623]
_cell_length_b [7.7648]
_cell_length_c [9.4887]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.0942]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Cu2Pb5Cl12]
_chemical_formula_sum '[Cu4 Pb10 Cl24]'
_cell_volume [1089.8880]
_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
[
  Cu  Cu0  4  0.0000  0.1722  0.0000  1.0
  Pb  Pb1  4  0.1825  0.5000  0.3369  1.0
  Pb  Pb2  4  0.1845  0.5000  0.8424  1.0
  Pb  Pb3  2  0.0000  0.0000  0.5000  1.0
  Cl  Cl4  8  0.1496  0.2728  0.0708  1.0
  Cl  Cl5  8  0.1583  0.2487  0.5829  1.0
  Cl  Cl6  4  0.0031  0.5000  0.7330  1.0
  Cl  Cl7  4  0.0067  0.0000  0.2082  1.0
]