# generated using pymatgen
data_Y5Sc5(Si5Ir2)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.47916308
_cell_length_b   12.47916308
_cell_length_c   4.16498968
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Y5Sc5(Si5Ir2)4
_chemical_formula_sum   'Y5 Sc5 Si20 Ir8'
_cell_volume   648.61180717
_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
  Y  Y0  1  0.00000000  0.00000000  0.00000000  1.0
  Y  Y1  1  0.88468747  0.38598632  0.50000000  1.0
  Y  Y2  1  0.11531253  0.61401368  0.50000000  1.0
  Y  Y3  1  0.38598632  0.11531253  0.50000000  1.0
  Y  Y4  1  0.61401368  0.88468747  0.50000000  1.0
  Sc  Sc5  1  0.50000000  0.50000000  0.00000000  1.0
  Sc  Sc6  1  0.67250263  0.17456571  0.50000000  1.0
  Sc  Sc7  1  0.32749737  0.82543429  0.50000000  1.0
  Sc  Sc8  1  0.17456571  0.32749737  0.50000000  1.0
  Sc  Sc9  1  0.82543429  0.67250263  0.50000000  1.0
  Si  Si10  1  0.56673375  0.06859782  0.00000000  1.0
  Si  Si11  1  0.43326625  0.93140218  0.00000000  1.0
  Si  Si12  1  0.06859782  0.43326625  0.00000000  1.0
  Si  Si13  1  0.93140218  0.56673375  0.00000000  1.0
  Si  Si14  1  0.66577503  0.70013823  0.00000000  1.0
  Si  Si15  1  0.33422497  0.29986177  0.00000000  1.0
  Si  Si16  1  0.16614612  0.79941089  0.00000000  1.0
  Si  Si17  1  0.83385388  0.20058911  0.00000000  1.0
  Si  Si18  1  0.29986177  0.66577503  0.00000000  1.0
  Si  Si19  1  0.70013823  0.33422497  0.00000000  1.0
  Si  Si20  1  0.20058911  0.16614612  0.00000000  1.0
  Si  Si21  1  0.79941089  0.83385388  0.00000000  1.0
  Si  Si22  1  0.65046333  0.50782332  0.50000000  1.0
  Si  Si23  1  0.34953667  0.49217668  0.50000000  1.0
  Si  Si24  1  0.15748274  0.99268045  0.50000000  1.0
  Si  Si25  1  0.84251726  0.00731955  0.50000000  1.0
  Si  Si26  1  0.49217668  0.65046333  0.50000000  1.0
  Si  Si27  1  0.50782332  0.34953667  0.50000000  1.0
  Si  Si28  1  0.00731955  0.15748274  0.50000000  1.0
  Si  Si29  1  0.99268045  0.84251726  0.50000000  1.0
  Ir  Ir30  1  0.74244839  0.52062443  0.00000000  1.0
  Ir  Ir31  1  0.25755161  0.47937557  0.00000000  1.0
  Ir  Ir32  1  0.24630348  0.97910590  0.00000000  1.0
  Ir  Ir33  1  0.75369652  0.02089410  0.00000000  1.0
  Ir  Ir34  1  0.47937557  0.74244839  0.00000000  1.0
  Ir  Ir35  1  0.52062443  0.25755161  0.00000000  1.0
  Ir  Ir36  1  0.02089410  0.24630348  0.00000000  1.0
  Ir  Ir37  1  0.97910590  0.75369652  0.00000000  1.0