# generated using pymatgen
data_ErU3(Al3Ir)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.54529404
_cell_length_b   7.55596651
_cell_length_c   9.37170938
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.42926245
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ErU3(Al3Ir)6
_chemical_formula_sum   'Er1 U3 Al18 Ir6'
_cell_volume   465.35534006
_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  0.99470466  0.67151860  0.75000000  1.0
  U  U1  1  0.00475156  0.32529803  0.25000000  1.0
  U  U2  1  0.67050956  0.99418028  0.75000000  1.0
  U  U3  1  0.32906409  0.00399373  0.25000000  1.0
  Al  Al4  1  0.12974276  0.12909727  0.75000000  1.0
  Al  Al5  1  0.86623285  0.86696201  0.25000000  1.0
  Al  Al6  1  0.00312042  0.33797176  0.57450359  1.0
  Al  Al7  1  0.99743658  0.66500258  0.42719311  1.0
  Al  Al8  1  0.99743658  0.66500258  0.07280689  1.0
  Al  Al9  1  0.33384643  0.00035015  0.92501441  1.0
  Al  Al10  1  0.00312042  0.33797176  0.92549641  1.0
  Al  Al11  1  0.66239042  0.99666036  0.07319541  1.0
  Al  Al12  1  0.66239042  0.99666036  0.42680459  1.0
  Al  Al13  1  0.33384643  0.00035015  0.57498559  1.0
  Al  Al14  1  0.33659130  0.33593092  0.04677933  1.0
  Al  Al15  1  0.66781797  0.66698728  0.94651894  1.0
  Al  Al16  1  0.66781797  0.66698728  0.55348106  1.0
  Al  Al17  1  0.33659130  0.33593092  0.45322067  1.0
  Al  Al18  1  0.33885744  0.54811440  0.75000000  1.0
  Al  Al19  1  0.66048295  0.45409807  0.25000000  1.0
  Al  Al20  1  0.54924601  0.34202598  0.75000000  1.0
  Al  Al21  1  0.45187683  0.65772998  0.25000000  1.0
  Ir  Ir22  1  0.67332959  0.32877783  0.50033810  1.0
  Ir  Ir23  1  0.32679656  0.67093451  0.49932578  1.0
  Ir  Ir24  1  0.32679656  0.67093451  0.00067422  1.0
  Ir  Ir25  1  0.67332959  0.32877783  0.99966190  1.0
  Ir  Ir26  1  0.00093938  0.00087643  0.49884452  1.0
  Ir  Ir27  1  0.00093938  0.00087643  0.00115548  1.0