# generated using pymatgen
data_Er20Zn6IrRu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.31924939
_cell_length_b   9.31919734
_cell_length_c   9.44347923
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99983607
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Er20Zn6IrRu
_chemical_formula_sum   'Er20 Zn6 Ir1 Ru1'
_cell_volume   710.26893626
_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
  Er  Er0  1  0.99999800  0.99999582  0.49942513  1.0
  Er  Er1  1  0.99999800  0.99999582  0.00057487  1.0
  Er  Er2  1  0.20716164  0.79284154  0.44236980  1.0
  Er  Er3  1  0.20716329  0.41432442  0.44236703  1.0
  Er  Er4  1  0.58567905  0.79283961  0.44236754  1.0
  Er  Er5  1  0.79239397  0.20761050  0.55881386  1.0
  Er  Er6  1  0.79239151  0.58478003  0.55881611  1.0
  Er  Er7  1  0.41522232  0.20761320  0.55881530  1.0
  Er  Er8  1  0.79239397  0.20761050  0.94118614  1.0
  Er  Er9  1  0.79239151  0.58478003  0.94118389  1.0
  Er  Er10  1  0.41522232  0.20761320  0.94118470  1.0
  Er  Er11  1  0.20716164  0.79284154  0.05763020  1.0
  Er  Er12  1  0.20716329  0.41432442  0.05763297  1.0
  Er  Er13  1  0.58567905  0.79283961  0.05763246  1.0
  Er  Er14  1  0.54160922  0.45840002  0.25000000  1.0
  Er  Er15  1  0.54160282  0.08320437  0.25000000  1.0
  Er  Er16  1  0.91679157  0.45839972  0.25000000  1.0
  Er  Er17  1  0.45834143  0.54166775  0.75000000  1.0
  Er  Er18  1  0.45834031  0.91667816  0.75000000  1.0
  Er  Er19  1  0.08332194  0.54166092  0.75000000  1.0
  Zn  Zn20  1  0.88577182  0.11422459  0.25000000  1.0
  Zn  Zn21  1  0.88576909  0.77154281  0.25000000  1.0
  Zn  Zn22  1  0.22845520  0.11422582  0.25000000  1.0
  Zn  Zn23  1  0.11441592  0.88557384  0.75000000  1.0
  Zn  Zn24  1  0.11442050  0.22884213  0.75000000  1.0
  Zn  Zn25  1  0.77115484  0.88557527  0.75000000  1.0
  Ir  Ir26  1  0.33333012  0.66667063  0.25000000  1.0
  Ru  Ru27  1  0.66666264  0.33331873  0.75000000  1.0