# generated using pymatgen
data_ErHf(Al3Ir)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.45685613
_cell_length_b   7.44590483
_cell_length_c   9.25456152
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.69480950
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ErHf(Al3Ir)3
_chemical_formula_sum   'Er2 Hf2 Al18 Ir6'
_cell_volume   446.36189477
_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  0.67107102  0.99313347  0.75000000  1.0
  Er  Er1  1  0.32892898  0.00686653  0.25000000  1.0
  Hf  Hf2  1  0.99380179  0.67278709  0.75000000  1.0
  Hf  Hf3  1  0.00619821  0.32721291  0.25000000  1.0
  Al  Al4  1  0.12881873  0.12665194  0.75000000  1.0
  Al  Al5  1  0.87118127  0.87334806  0.25000000  1.0
  Al  Al6  1  0.00003322  0.33711285  0.57409315  1.0
  Al  Al7  1  0.99996678  0.66288715  0.42590685  1.0
  Al  Al8  1  0.99996678  0.66288715  0.07409315  1.0
  Al  Al9  1  0.33294350  0.99897889  0.92324326  1.0
  Al  Al10  1  0.00003322  0.33711285  0.92590685  1.0
  Al  Al11  1  0.66705650  0.00102111  0.07675674  1.0
  Al  Al12  1  0.66705650  0.00102111  0.42324326  1.0
  Al  Al13  1  0.33294350  0.99897889  0.57675674  1.0
  Al  Al14  1  0.33163837  0.33377529  0.05523689  1.0
  Al  Al15  1  0.66836163  0.66622471  0.94476311  1.0
  Al  Al16  1  0.66836163  0.66622471  0.55523689  1.0
  Al  Al17  1  0.33163837  0.33377529  0.44476311  1.0
  Al  Al18  1  0.33409471  0.54761728  0.75000000  1.0
  Al  Al19  1  0.66590529  0.45238272  0.25000000  1.0
  Al  Al20  1  0.55417390  0.34492890  0.75000000  1.0
  Al  Al21  1  0.44582610  0.65507110  0.25000000  1.0
  Ir  Ir22  1  0.67266419  0.32761433  0.49950985  1.0
  Ir  Ir23  1  0.32733581  0.67238567  0.50049015  1.0
  Ir  Ir24  1  0.32733581  0.67238567  0.99950985  1.0
  Ir  Ir25  1  0.67266419  0.32761433  0.00049015  1.0
  Ir  Ir26  1  0.00000000  0.00000000  0.50000000  1.0
  Ir  Ir27  1  0.00000000  0.00000000  0.00000000  1.0