# generated using pymatgen
data_Ni2HgSe3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.01199048
_cell_length_b   7.01199013
_cell_length_c   5.40025830
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999716
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni2HgSe3
_chemical_formula_sum   'Ni4 Hg2 Se6'
_cell_volume   229.94702284
_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
  Ni  Ni0  1  0.00000000  0.00000000  0.00000000  1.0
  Ni  Ni1  1  0.50000000  0.00000000  0.00000000  1.0
  Ni  Ni2  1  0.00000000  0.50000000  0.00000000  1.0
  Ni  Ni3  1  0.50000000  0.50000000  0.00000000  1.0
  Hg  Hg4  1  0.33333300  0.66666600  0.34104289  1.0
  Hg  Hg5  1  0.66666700  0.33333400  0.65895711  1.0
  Se  Se6  1  0.34291775  0.17145888  0.22251125  1.0
  Se  Se7  1  0.82854112  0.17145888  0.22251125  1.0
  Se  Se8  1  0.82854012  0.65708225  0.22251125  1.0
  Se  Se9  1  0.17145888  0.34291675  0.77748875  1.0
  Se  Se10  1  0.17145888  0.82854012  0.77748875  1.0
  Se  Se11  1  0.65708125  0.82854012  0.77748875  1.0