# generated using pymatgen
data_Sc3In3Ni2Hg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.54561188
_cell_length_b   7.54561119
_cell_length_c   3.46005624
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000305
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc3In3Ni2Hg
_chemical_formula_sum   'Sc3 In3 Ni2 Hg1'
_cell_volume   170.60928464
_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  0.58174002  0.96474357  0.00000000  1.0
  Sc  Sc1  1  0.38300255  0.41825998  0.00000000  1.0
  Sc  Sc2  1  0.03525643  0.61699745  0.00000000  1.0
  In  In3  1  0.74056950  0.74216144  0.50000000  1.0
  In  In4  1  0.00159294  0.25943050  0.50000000  1.0
  In  In5  1  0.25783856  0.99840706  0.50000000  1.0
  Ni  Ni6  1  0.00000000  0.00000000  0.00000000  1.0
  Ni  Ni7  1  0.33333300  0.66666700  0.50000000  1.0
  Hg  Hg8  1  0.66666700  0.33333300  0.50000000  1.0