# generated using pymatgen
data_HgS
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.19635635
_cell_length_b   4.19635635
_cell_length_c   6.87025325
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000205
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HgS
_chemical_formula_sum   'Hg2 S2'
_cell_volume   104.77268912
_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
  Hg  Hg0  1  -0.00000000  -0.00000000  0.00012330  1.0
  Hg  Hg1  1  0.33333200  0.66666600  0.50012330  1.0
  S  S2  1  0.00000000  0.00000000  0.37487670  1.0
  S  S3  1  0.33333200  0.66666600  0.87487670  1.0