# generated using pymatgen
data_CuO2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.86818959
_cell_length_b   4.86818959
_cell_length_c   4.86818927
_cell_angle_alpha   35.20839978
_cell_angle_beta   35.20839978
_cell_angle_gamma   35.20839748
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CuO2
_chemical_formula_sum   'Cu1 O2'
_cell_volume   34.25531865
_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  1  0.00000000  0.00000000  0.00000000  1.0
  O  O1  1  0.26513200  0.26513200  0.26513200  1.0
  O  O2  1  0.73486800  0.73486800  0.73486800  1.0