# generated using pymatgen
data_Er4Sc(SiHg)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.63488404
_cell_length_b   8.63488389
_cell_length_c   7.29940970
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   129.80229438
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Er4Sc(SiHg)2
_chemical_formula_sum   'Er8 Sc2 Si4 Hg4'
_cell_volume   418.12658519
_cell_formula_units_Z   2
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
  Er  Er0  1  0.05389647  0.30870874  0.32446484  1.0
  Er  Er1  1  0.94610353  0.69129126  0.67553516  1.0
  Er  Er2  1  0.44610353  0.19129126  0.82446484  1.0
  Er  Er3  1  0.80870874  0.55389647  0.17553516  1.0
  Er  Er4  1  0.55389647  0.80870874  0.17553516  1.0
  Er  Er5  1  0.19129126  0.44610353  0.82446484  1.0
  Er  Er6  1  0.69129126  0.94610353  0.67553516  1.0
  Er  Er7  1  0.30870874  0.05389647  0.32446484  1.0
  Sc  Sc8  1  0.00000000  0.00000000  0.00000000  1.0
  Sc  Sc9  1  0.50000000  0.50000000  0.50000000  1.0
  Si  Si10  1  0.37872927  0.37872927  0.12455245  1.0
  Si  Si11  1  0.62127073  0.62127073  0.87544755  1.0
  Si  Si12  1  0.12127073  0.12127073  0.62455245  1.0
  Si  Si13  1  0.87872927  0.87872927  0.37544755  1.0
  Hg  Hg14  1  0.78243735  0.21756265  0.00000000  1.0
  Hg  Hg15  1  0.21756365  0.78243735  0.00000000  1.0
  Hg  Hg16  1  0.71756265  0.28243735  0.50000000  1.0
  Hg  Hg17  1  0.28243735  0.71756265  0.50000000  1.0