# generated using pymatgen
data_LiLu8(B8Ir)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.57830272
_cell_length_b   9.02579343
_cell_length_c   11.36433398
_cell_angle_alpha   90.10872283
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiLu8(B8Ir)3
_chemical_formula_sum   'Li1 Lu8 B24 Ir3'
_cell_volume   367.03347471
_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
  Li  Li0  1  0.00000000  0.63715343  0.32309179  1.0
  Lu  Lu1  1  0.00000000  0.32693837  0.41227585  1.0
  Lu  Lu2  1  0.00000000  0.67698114  0.58081003  1.0
  Lu  Lu3  1  0.00000000  0.81924680  0.08847873  1.0
  Lu  Lu4  1  0.00000000  0.18069194  0.91496717  1.0
  Lu  Lu5  1  0.00000000  0.94012184  0.37219187  1.0
  Lu  Lu6  1  0.00000000  0.05599004  0.62516447  1.0
  Lu  Lu7  1  0.00000000  0.44727810  0.12963530  1.0
  Lu  Lu8  1  0.00000000  0.55595296  0.87412331  1.0
  B  B9  1  0.50000000  0.55232694  0.43459920  1.0
  B  B10  1  0.50000000  0.44796128  0.56372035  1.0
  B  B11  1  0.50000000  0.05397838  0.06564080  1.0
  B  B12  1  0.50000000  0.94700049  0.93455121  1.0
  B  B13  1  0.50000000  0.74808795  0.42021882  1.0
  B  B14  1  0.50000000  0.25146257  0.57790279  1.0
  B  B15  1  0.50000000  0.25230059  0.08054097  1.0
  B  B16  1  0.50000000  0.75006664  0.92130959  1.0
  B  B17  1  0.50000000  0.79348529  0.26281187  1.0
  B  B18  1  0.50000000  0.20579666  0.73670181  1.0
  B  B19  1  0.50000000  0.29578217  0.23668993  1.0
  B  B20  1  0.50000000  0.70600090  0.76356752  1.0
  B  B21  1  0.50000000  0.63388759  0.18374502  1.0
  B  B22  1  0.50000000  0.36734655  0.81815244  1.0
  B  B23  1  0.50000000  0.13128740  0.31519556  1.0
  B  B24  1  0.50000000  0.86712548  0.68207041  1.0
  B  B25  1  0.50000000  0.97909582  0.21300988  1.0
  B  B26  1  0.50000000  0.01869772  0.78634825  1.0
  B  B27  1  0.50000000  0.48096020  0.28833342  1.0
  B  B28  1  0.50000000  0.51791756  0.71240494  1.0
  B  B29  1  0.50000000  0.60857730  0.03029781  1.0
  B  B30  1  0.50000000  0.39472715  0.97196232  1.0
  B  B31  1  0.50000000  0.10611704  0.47009034  1.0
  B  B32  1  0.50000000  0.89157052  0.52869082  1.0
  Ir  Ir33  1  0.00000000  0.35757658  0.68322521  1.0
  Ir  Ir34  1  0.00000000  0.13784240  0.17589067  1.0
  Ir  Ir35  1  0.00000000  0.86266423  0.82159053  1.0