# generated using pymatgen
data_PmHgO
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.98408069
_cell_length_b   3.98408069
_cell_length_c   7.95673508
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   PmHgO
_chemical_formula_sum   'Pm2 Hg2 O2'
_cell_volume   126.29645202
_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
  Pm  Pm0  1  0.25000100  0.25000100  0.14487434  1.0
  Pm  Pm1  1  0.74999900  0.74999900  0.85512566  1.0
  Hg  Hg2  1  0.74999900  0.74999900  0.40830748  1.0
  Hg  Hg3  1  0.25000100  0.25000100  0.59169252  1.0
  O  O4  1  0.74999900  0.25000100  0.00000000  1.0
  O  O5  1  0.25000100  0.74999900  0.00000000  1.0