# generated using pymatgen
data_Sc4Ni2Hg5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.27207986
_cell_length_b   3.31736665
_cell_length_c   9.04290562
_cell_angle_alpha   90.00000000
_cell_angle_beta   93.40408414
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc4Ni2Hg5
_chemical_formula_sum   'Sc4 Ni2 Hg5'
_cell_volume   217.76754986
_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  0.29016590  0.50000100  0.06530175  1.0
  Sc  Sc1  1  0.68018639  0.50000100  0.33851193  1.0
  Sc  Sc2  1  0.31981261  0.50000100  0.66148807  1.0
  Sc  Sc3  1  0.70983410  0.50000100  0.93469825  1.0
  Ni  Ni4  1  0.57043640  0.00000000  0.13061539  1.0
  Ni  Ni5  1  0.42956360  0.00000000  0.86938361  1.0
  Hg  Hg6  1  0.94830116  0.00000000  0.16141605  1.0
  Hg  Hg7  1  0.33978212  0.00000000  0.35916707  1.0
  Hg  Hg8  1  0.00000000  0.00000000  0.50000000  1.0
  Hg  Hg9  1  0.66021888  0.00000000  0.64083193  1.0
  Hg  Hg10  1  0.05169884  0.00000000  0.83858395  1.0