# generated using pymatgen
data_LiLu8(AlB8)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.54640645
_cell_length_b   9.06672969
_cell_length_c   11.41239172
_cell_angle_alpha   90.09069274
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiLu8(AlB8)3
_chemical_formula_sum   'Li1 Lu8 Al3 B24'
_cell_volume   366.95710644
_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  0.36180103  0.67806368  1.0
  Lu  Lu1  1  0.00000000  0.82043033  0.08671921  1.0
  Lu  Lu2  1  0.00000000  0.17938329  0.91262336  1.0
  Lu  Lu3  1  0.00000000  0.32170832  0.41552902  1.0
  Lu  Lu4  1  0.00000000  0.67620211  0.58694041  1.0
  Lu  Lu5  1  0.00000000  0.44367753  0.12706299  1.0
  Lu  Lu6  1  0.00000000  0.55246396  0.86884524  1.0
  Lu  Lu7  1  0.00000000  0.94386959  0.37320234  1.0
  Lu  Lu8  1  0.00000000  0.06232935  0.62864461  1.0
  Al  Al9  1  0.00000000  0.13949189  0.17951977  1.0
  Al  Al10  1  0.00000000  0.86061369  0.82043291  1.0
  Al  Al11  1  0.00000000  0.63863831  0.32196791  1.0
  B  B12  1  0.50000000  0.05068233  0.06420124  1.0
  B  B13  1  0.50000000  0.94849977  0.93606328  1.0
  B  B14  1  0.50000000  0.55013744  0.43658929  1.0
  B  B15  1  0.50000000  0.44766656  0.56541129  1.0
  B  B16  1  0.50000000  0.25062996  0.07896919  1.0
  B  B17  1  0.50000000  0.74772676  0.92053518  1.0
  B  B18  1  0.50000000  0.75124363  0.42148240  1.0
  B  B19  1  0.50000000  0.25160940  0.57988419  1.0
  B  B20  1  0.50000000  0.29661919  0.23779306  1.0
  B  B21  1  0.50000000  0.70250397  0.76130311  1.0
  B  B22  1  0.50000000  0.79662668  0.26260880  1.0
  B  B23  1  0.50000000  0.20610518  0.73799219  1.0
  B  B24  1  0.50000000  0.13206993  0.31830259  1.0
  B  B25  1  0.50000000  0.86862996  0.68180305  1.0
  B  B26  1  0.50000000  0.63203403  0.18182211  1.0
  B  B27  1  0.50000000  0.36646832  0.81665653  1.0
  B  B28  1  0.50000000  0.47921384  0.28795741  1.0
  B  B29  1  0.50000000  0.51903375  0.71076421  1.0
  B  B30  1  0.50000000  0.97898801  0.21215159  1.0
  B  B31  1  0.50000000  0.02236187  0.78863873  1.0
  B  B32  1  0.50000000  0.10602026  0.47148034  1.0
  B  B33  1  0.50000000  0.89641839  0.52970276  1.0
  B  B34  1  0.50000000  0.60373891  0.02798734  1.0
  B  B35  1  0.50000000  0.39436046  0.97034969  1.0