# generated using pymatgen
data_Cu2Cl2O
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.85116421
_cell_length_b   6.40079332
_cell_length_c   6.19251964
_cell_angle_alpha   65.89288702
_cell_angle_beta   58.51537853
_cell_angle_gamma   55.59173445
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu2Cl2O
_chemical_formula_sum   'Cu4 Cl4 O2'
_cell_volume   188.56731199
_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  1  0.12500000  0.62500000  0.12500000  1.0
  Cu  Cu1  1  0.12500000  0.12500000  0.62500000  1.0
  Cu  Cu2  1  0.12500000  0.12500000  0.12500000  1.0
  Cu  Cu3  1  0.62500000  0.12500000  0.12500000  1.0
  Cl  Cl4  1  0.28814800  0.28814800  0.71185200  1.0
  Cl  Cl5  1  0.71185200  0.71185200  0.28814800  1.0
  Cl  Cl6  1  0.53814800  0.53814800  0.96185200  1.0
  Cl  Cl7  1  0.96185200  0.96185200  0.53814800  1.0
  O  O8  1  0.00000000  0.00000000  0.00000000  1.0
  O  O9  1  0.25000000  0.25000000  0.25000000  1.0