# generated using pymatgen
data_Sc11U(IrRu)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.56938183
_cell_length_b   6.44390076
_cell_length_c   13.66408048
_cell_angle_alpha   90.00000000
_cell_angle_beta   89.99996737
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc11U(IrRu)6
_chemical_formula_sum   'Sc11 U1 Ir6 Ru6'
_cell_volume   402.33397246
_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
  Sc  Sc0  1  0.50000000  0.74526783  0.00000000  1.0
  Sc  Sc1  1  0.99999477  0.25091422  0.17558760  1.0
  Sc  Sc2  1  0.99999454  0.74945463  0.16973584  1.0
  Sc  Sc3  1  0.49999420  0.25133417  0.33715541  1.0
  Sc  Sc4  1  0.49999399  0.75136010  0.33493257  1.0
  Sc  Sc5  1  0.00000000  0.25123630  0.50000000  1.0
  Sc  Sc6  1  0.00000000  0.75096536  0.50000000  1.0
  Sc  Sc7  1  0.50000480  0.25133417  0.66284459  1.0
  Sc  Sc8  1  0.50000501  0.75136010  0.66506743  1.0
  Sc  Sc9  1  0.00000523  0.25091422  0.82441240  1.0
  Sc  Sc10  1  0.00000546  0.74945463  0.83026416  1.0
  U  U11  1  0.50000000  0.24538887  0.00000000  1.0
  Ir  Ir12  1  0.00000000  0.99636867  0.00000000  1.0
  Ir  Ir13  1  0.49999394  0.49850609  0.16647324  1.0
  Ir  Ir14  1  0.99999524  0.00044132  0.33375142  1.0
  Ir  Ir15  1  0.50000100  0.50203993  0.50000000  1.0
  Ir  Ir16  1  0.00000476  0.00044132  0.66624858  1.0
  Ir  Ir17  1  0.50000806  0.49850609  0.83352676  1.0
  Ru  Ru18  1  0.00000000  0.48964410  0.00000000  1.0
  Ru  Ru19  1  0.49999552  0.00528731  0.16263353  1.0
  Ru  Ru20  1  0.99999492  0.50200072  0.33381851  1.0
  Ru  Ru21  1  0.50000100  0.00048583  0.50000000  1.0
  Ru  Ru22  1  0.00000508  0.50200072  0.66618149  1.0
  Ru  Ru23  1  0.50000448  0.00528731  0.83736647  1.0