# generated using pymatgen
data_HgSe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.37886567
_cell_length_b   4.37886594
_cell_length_c   4.37886635
_cell_angle_alpha   60.00001242
_cell_angle_beta   60.00001033
_cell_angle_gamma   60.00000004
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HgSe
_chemical_formula_sum   'Hg1 Se1'
_cell_volume   59.37040878
_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
  Hg  Hg0  1  -0.00000000  -0.00000000  0.00000000  1.0
  Se  Se1  1  0.25000000  0.25000000  0.25000000  1.0