# generated using pymatgen
data_Er8Sc2(IrRh)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.60833987
_cell_length_b   10.61233795
_cell_length_c   6.21638469
_cell_angle_alpha   90.00096017
_cell_angle_beta   90.02810690
_cell_angle_gamma   90.00073090
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Er8Sc2(IrRh)3
_chemical_formula_sum   'Er16 Sc4 Ir6 Rh6'
_cell_volume   699.83607666
_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  0.28686209  0.08557362  0.38165134  1.0
  Er  Er1  1  0.28689505  0.91442183  0.88163300  1.0
  Er  Er2  1  0.71143490  0.08816438  0.88124064  1.0
  Er  Er3  1  0.71140821  0.91184538  0.38122027  1.0
  Er  Er4  1  0.58450000  0.78694645  0.88139044  1.0
  Er  Er5  1  0.58450591  0.21306159  0.38139115  1.0
  Er  Er6  1  0.41327440  0.78717109  0.38118079  1.0
  Er  Er7  1  0.41327527  0.21283533  0.88118221  1.0
  Er  Er8  1  0.21303928  0.41338259  0.61814221  1.0
  Er  Er9  1  0.21303996  0.58662361  0.11813494  1.0
  Er  Er10  1  0.78721979  0.41546031  0.11945913  1.0
  Er  Er11  1  0.78721972  0.58453966  0.61944924  1.0
  Er  Er12  1  0.91432871  0.71256541  0.11802939  1.0
  Er  Er13  1  0.91432787  0.28743098  0.61801378  1.0
  Er  Er14  1  0.08816936  0.71194344  0.61875657  1.0
  Er  Er15  1  0.08816188  0.28804807  0.11874051  1.0
  Sc  Sc16  1  0.00020262  0.99922374  0.50018742  1.0
  Sc  Sc17  1  0.00028710  0.00072631  0.00017040  1.0
  Sc  Sc18  1  0.50045256  0.49972159  0.00007250  1.0
  Sc  Sc19  1  0.50044942  0.50029382  0.50007324  1.0
  Ir  Ir20  1  0.14825893  0.14966215  0.74952991  1.0
  Ir  Ir21  1  0.14826305  0.85033198  0.24954936  1.0
  Ir  Ir22  1  0.65091839  0.34975672  0.75004890  1.0
  Ir  Ir23  1  0.65091805  0.65025489  0.25005146  1.0
  Ir  Ir24  1  0.35066735  0.35016091  0.24998631  1.0
  Ir  Ir25  1  0.35067062  0.64984448  0.74998775  1.0
  Rh  Rh26  1  0.84930553  0.14870092  0.25052543  1.0
  Rh  Rh27  1  0.84929370  0.85130088  0.75053615  1.0
  Rh  Rh28  1  0.50117542  0.00007141  0.12972721  1.0
  Rh  Rh29  1  0.50117489  0.99993063  0.62972851  1.0
  Rh  Rh30  1  0.00014945  0.49997591  0.87010310  1.0
  Rh  Rh31  1  0.00015350  0.50003090  0.37010972  1.0