data_[Cu2Cl13]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cu  1.9000  1.3500  0.8200
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [7.2874]
_cell_length_b [7.9230]
_cell_length_c [8.1876]
_cell_angle_alpha [82.7011]
_cell_angle_beta [89.4786]
_cell_angle_gamma [85.2409]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Cu2Cl13]
_chemical_formula_sum '[Cu2 Cl13]'
_cell_volume [467.2902]
_cell_formula_units_Z [1]
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  2  0.2894  0.0910  0.9534  1.0
  Cl  Cl1  2  0.1842  0.8754  0.6643  1.0
  Cl  Cl2  2  0.1842  0.3416  0.8415  1.0
  Cl  Cl3  2  0.2205  0.3681  0.4965  1.0
  Cl  Cl4  2  0.2347  0.4003  0.2478  1.0
  Cl  Cl5  2  0.2960  0.8599  0.4417  1.0
  Cl  Cl6  2  0.4123  0.8414  0.0824  1.0
  Cl  Cl7  1  0.0000  0.0000  0.0000  1.0
]