data_[Cu2H2Cl3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cu  1.9000  1.3500  0.8200
  H  2.2000  0.2500  0.0000
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [3.7446]
_cell_length_b [5.5852]
_cell_length_c [6.3285]
_cell_angle_alpha [110.6819]
_cell_angle_beta [93.8909]
_cell_angle_gamma [100.9683]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Cu2H2Cl3]
_chemical_formula_sum '[Cu2 H2 Cl3]'
_cell_volume [120.2411]
_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  0.3093  0.1121  0.7344  1
  H  H1  2  0.4476  0.4741  0.0408  1
  Cl  Cl2  2  0.1929  0.7199  0.4058  1
  Cl  Cl3  1  0.0000  0.0000  0.0000  1
]