# generated using pymatgen
data_SmHg2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.41886400
_cell_length_b   5.44303424
_cell_length_c   5.44303424
_cell_angle_alpha   120.00000297
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SmHg2
_chemical_formula_sum   'Sm1 Hg2'
_cell_volume   87.71918283
_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
  Sm  Sm0  1  0.00000000  0.00000000  0.00000000  1.0
  Hg  Hg1  1  0.05489600  0.66666700  0.33333300  1.0
  Hg  Hg2  1  0.94510400  0.33333300  0.66666700  1.0