# generated using pymatgen
data_LuB4Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.52837907
_cell_length_b   5.90701546
_cell_length_c   11.46459463
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LuB4Ir
_chemical_formula_sum   'Lu4 B16 Ir4'
_cell_volume   238.94725616
_cell_formula_units_Z   4
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
  Lu  Lu0  1  0.00000000  0.63324357  0.35156518  1.0
  Lu  Lu1  1  0.00000000  0.36675643  0.64843482  1.0
  Lu  Lu2  1  0.00000000  0.13324357  0.14843482  1.0
  Lu  Lu3  1  0.00000000  0.86675643  0.85156518  1.0
  B  B4  1  0.50000000  0.79341147  0.18856767  1.0
  B  B5  1  0.50000000  0.20658853  0.81143233  1.0
  B  B6  1  0.50000000  0.29341147  0.31143233  1.0
  B  B7  1  0.50000000  0.70658853  0.68856767  1.0
  B  B8  1  0.50000000  0.86423431  0.02876905  1.0
  B  B9  1  0.50000000  0.13576569  0.97123095  1.0
  B  B10  1  0.50000000  0.36423431  0.47123095  1.0
  B  B11  1  0.50000000  0.63576569  0.52876905  1.0
  B  B12  1  0.50000000  0.88702289  0.45228234  1.0
  B  B13  1  0.50000000  0.11297711  0.54771766  1.0
  B  B14  1  0.50000000  0.38702289  0.04771766  1.0
  B  B15  1  0.50000000  0.61297711  0.95228234  1.0
  B  B16  1  0.50000000  0.97776480  0.30613284  1.0
  B  B17  1  0.50000000  0.02223520  0.69386716  1.0
  B  B18  1  0.50000000  0.47776480  0.19386716  1.0
  B  B19  1  0.50000000  0.52223520  0.80613284  1.0
  Ir  Ir20  1  0.00000000  0.64615377  0.09775688  1.0
  Ir  Ir21  1  0.00000000  0.35384623  0.90224312  1.0
  Ir  Ir22  1  0.00000000  0.14615377  0.40224312  1.0
  Ir  Ir23  1  0.00000000  0.85384623  0.59775688  1.0