# generated using pymatgen
data_Er4BeSi6Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.95891028
_cell_length_b   7.95890980
_cell_length_c   8.00812892
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999787
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Er4BeSi6Ir
_chemical_formula_sum   'Er8 Be2 Si12 Ir2'
_cell_volume   439.30777460
_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  0.99990232  0.49995116  0.24572519  1.0
  Er  Er1  1  0.50004884  0.49995116  0.24572519  1.0
  Er  Er2  1  0.49995116  0.99990232  0.75427481  1.0
  Er  Er3  1  0.00009768  0.50004884  0.75427481  1.0
  Er  Er4  1  0.49995116  0.50004884  0.75427481  1.0
  Er  Er5  1  0.50004884  0.00009768  0.24572519  1.0
  Er  Er6  1  0.00000000  0.00000000  0.74672667  1.0
  Er  Er7  1  0.00000000  0.00000000  0.25327333  1.0
  Be  Be8  1  0.66666700  0.33333300  0.49974208  1.0
  Be  Be9  1  0.33333300  0.66666700  0.50025792  1.0
  Si  Si10  1  0.17216264  0.82783736  0.49967365  1.0
  Si  Si11  1  0.17216264  0.34432329  0.49967365  1.0
  Si  Si12  1  0.65567671  0.82783736  0.49967365  1.0
  Si  Si13  1  0.33272148  0.16636124  0.99995605  1.0
  Si  Si14  1  0.82783736  0.65567671  0.50032635  1.0
  Si  Si15  1  0.83363876  0.16636124  0.99995605  1.0
  Si  Si16  1  0.83363876  0.66727852  0.99995605  1.0
  Si  Si17  1  0.16636124  0.33272148  0.00004395  1.0
  Si  Si18  1  0.66727852  0.83363876  0.00004395  1.0
  Si  Si19  1  0.34432329  0.17216264  0.50032635  1.0
  Si  Si20  1  0.82783736  0.17216264  0.50032635  1.0
  Si  Si21  1  0.16636124  0.83363876  0.00004395  1.0
  Ir  Ir22  1  0.33333300  0.66666700  0.00007200  1.0
  Ir  Ir23  1  0.66666700  0.33333300  0.99992800  1.0