# generated using pymatgen
data_LiLu2AlB8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.89212846
_cell_length_b   5.89212840
_cell_length_c   3.44244139
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   104.04831141
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiLu2AlB8
_chemical_formula_sum   'Li1 Lu2 Al1 B8'
_cell_volume   115.93741565
_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  0.67637514  0.67637514  0.00000000  1.0
  Lu  Lu1  1  0.19642843  0.80048957  0.00000000  1.0
  Lu  Lu2  1  0.80048957  0.19642843  0.00000000  1.0
  Al  Al3  1  0.32864706  0.32864706  0.00000000  1.0
  B  B4  1  0.88107953  0.56418975  0.50000000  1.0
  B  B5  1  0.40942965  0.59381000  0.50000000  1.0
  B  B6  1  0.87659147  0.87659147  0.50000000  1.0
  B  B7  1  0.56418975  0.88107953  0.50000000  1.0
  B  B8  1  0.43807987  0.11633102  0.50000000  1.0
  B  B9  1  0.11854851  0.11854851  0.50000000  1.0
  B  B10  1  0.59381000  0.40942965  0.50000000  1.0
  B  B11  1  0.11633102  0.43807987  0.50000000  1.0