# generated using pymatgen
data_Sc2GaHg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.66743289
_cell_length_b   11.66743289
_cell_length_c   11.66743289
_cell_angle_alpha   120.95005834
_cell_angle_beta   120.61457134
_cell_angle_gamma   88.65050039
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc2GaHg
_chemical_formula_sum   'Sc2 Ga1 Hg1'
_cell_volume   1109.45444405
_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
  Sc  Sc0  1  0.00000000  0.23169900  0.23169900  1.0
  Sc  Sc1  1  0.00000000  0.76830100  0.76830100  1.0
  Ga  Ga2  1  0.00000000  0.00000000  0.00000000  1.0
  Hg  Hg3  1  0.00000000  0.50000000  0.50000000  1.0