# generated using pymatgen
data_YErSi3Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.11735948
_cell_length_b   8.12147821
_cell_length_c   7.91493690
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.01482668
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YErSi3Ir
_chemical_formula_sum   'Y4 Er4 Si12 Ir4'
_cell_volume   451.81749855
_cell_formula_units_Z   4
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
  Y  Y0  1  0.00034621  0.00015664  0.25000000  1.0
  Y  Y1  1  0.00009715  0.00005921  0.75000000  1.0
  Y  Y2  1  0.49082483  0.50885011  0.25000000  1.0
  Y  Y3  1  0.49081267  0.98199508  0.25000000  1.0
  Er  Er4  1  0.01600384  0.50803676  0.25000000  1.0
  Er  Er5  1  0.50968610  0.49048904  0.75000000  1.0
  Er  Er6  1  0.98081820  0.49038140  0.75000000  1.0
  Er  Er7  1  0.50969912  0.01917211  0.75000000  1.0
  Si  Si8  1  0.83350736  0.16679026  0.49961863  1.0
  Si  Si9  1  0.83349635  0.66668760  0.49962510  1.0
  Si  Si10  1  0.33376551  0.16688152  0.50028217  1.0
  Si  Si11  1  0.83350736  0.16679026  0.00038137  1.0
  Si  Si12  1  0.83349635  0.66668760  0.00037490  1.0
  Si  Si13  1  0.33376551  0.16688152  0.99971783  1.0
  Si  Si14  1  0.16689440  0.83264981  0.99765945  1.0
  Si  Si15  1  0.66579169  0.83289931  0.99635055  1.0
  Si  Si16  1  0.16691122  0.33428179  0.99764906  1.0
  Si  Si17  1  0.16689440  0.83264981  0.50234055  1.0
  Si  Si18  1  0.66579169  0.83289931  0.50364945  1.0
  Si  Si19  1  0.16691122  0.33428179  0.50235094  1.0
  Ir  Ir20  1  0.66771944  0.33384528  0.47523236  1.0
  Ir  Ir21  1  0.66771944  0.33384528  0.02476764  1.0
  Ir  Ir22  1  0.33277096  0.66639626  0.96639413  1.0
  Ir  Ir23  1  0.33277096  0.66639626  0.53360587  1.0