# generated using pymatgen
data_CuHgO2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.74961799
_cell_length_b   3.74961799
_cell_length_c   6.01554081
_cell_angle_alpha   70.92135047
_cell_angle_beta   70.92135047
_cell_angle_gamma   46.92490718
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CuHgO2
_chemical_formula_sum   'Cu1 Hg1 O2'
_cell_volume   57.72443156
_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
  Hg  Hg1  1  0.50000000  0.50000000  0.50000000  1.0
  O  O2  1  0.38656600  0.38656600  0.21972000  1.0
  O  O3  1  0.61343400  0.61343400  0.78028000  1.0