# generated using pymatgen
data_Mg2Hg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.63206195
_cell_length_b   6.16307759
_cell_length_c   8.76472405
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg2Hg
_chemical_formula_sum   'Mg8 Hg4'
_cell_volume   250.21321410
_cell_formula_units_Z   4
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
  Mg  Mg0  1  0.25000000  0.95822631  0.70672764  1.0
  Mg  Mg1  1  0.75000000  0.04177369  0.29327236  1.0
  Mg  Mg2  1  0.25000000  0.45822631  0.79327236  1.0
  Mg  Mg3  1  0.75000000  0.54177369  0.20672764  1.0
  Mg  Mg4  1  0.75000000  0.17640991  0.94049501  1.0
  Mg  Mg5  1  0.25000000  0.82359009  0.05950499  1.0
  Mg  Mg6  1  0.75000000  0.67640991  0.55950499  1.0
  Mg  Mg7  1  0.25000000  0.32359009  0.44049501  1.0
  Hg  Hg8  1  0.25000000  0.78379988  0.38351578  1.0
  Hg  Hg9  1  0.75000000  0.21620012  0.61648422  1.0
  Hg  Hg10  1  0.25000000  0.28379988  0.11648422  1.0
  Hg  Hg11  1  0.75000000  0.71620012  0.88351578  1.0