# generated using pymatgen
data_CuAuO2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.79875602
_cell_length_b   3.29211147
_cell_length_c   6.09561905
_cell_angle_alpha   97.31841068
_cell_angle_beta   90.00001467
_cell_angle_gamma   115.15510186
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CuAuO2
_chemical_formula_sum   'Cu1 Au1 O2'
_cell_volume   50.33142077
_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  0.50000000  -0.00000000  0.00000000  1.0
  Au  Au1  1  -0.00000000  -0.00000000  0.50000000  1.0
  O  O2  1  0.90915379  0.81830759  0.17090122  1.0
  O  O3  1  0.09084621  0.18169241  0.82909878  1.0