# generated using pymatgen
data_Ag2HgI4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.65620990
_cell_length_b   4.65620990
_cell_length_c   50.30854055
_cell_angle_alpha   88.14722467
_cell_angle_beta   88.14722467
_cell_angle_gamma   67.87971100
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ag2HgI4
_chemical_formula_sum   'Ag6 Hg3 I12'
_cell_volume   1009.65532681
_cell_formula_units_Z   3
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
  Ag  Ag0  1  0.74639800  0.74639800  0.25100500  1.0
  Ag  Ag1  1  0.34456000  0.34456000  0.32662300  1.0
  Ag  Ag2  1  0.93671600  0.93671600  0.40065100  1.0
  Ag  Ag3  1  0.24431100  0.24431100  0.76748300  1.0
  Ag  Ag4  1  0.42764300  0.42764300  0.91493900  1.0
  Ag  Ag5  1  0.83732000  0.83732000  0.84099300  1.0
  Hg  Hg6  1  0.55821800  0.55821800  0.47966800  1.0
  Hg  Hg7  1  0.07315100  0.07315100  0.57861300  1.0
  Hg  Hg8  1  0.61680000  0.61680000  0.67973900  1.0
  I  I9  1  0.68731100  0.68731100  0.05540600  1.0
  I  I10  1  0.18178800  0.18178800  0.07639500  1.0
  I  I11  1  0.80136600  0.80136600  0.19739400  1.0
  I  I12  1  0.39049700  0.39049700  0.27100500  1.0
  I  I13  1  0.98264000  0.98264000  0.34493700  1.0
  I  I14  1  0.57307600  0.57307600  0.41893000  1.0
  I  I15  1  0.14646400  0.14646400  0.49703600  1.0
  I  I16  1  0.74536900  0.74536900  0.62925300  1.0
  I  I17  1  0.28897000  0.28897000  0.70820600  1.0
  I  I18  1  0.88038200  0.88038200  0.78057200  1.0
  I  I19  1  0.47225700  0.47225700  0.85392400  1.0
  I  I20  1  0.06407300  0.06407300  0.92722700  1.0