# generated using pymatgen
data_Lu2B6Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.56993194
_cell_length_b   9.04665528
_cell_length_c   11.37400830
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Lu2B6Ir
_chemical_formula_sum   'Lu8 B24 Ir4'
_cell_volume   367.33433101
_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  0.31990642  0.41365021  1.0
  Lu  Lu1  1  0.00000000  0.68009358  0.58634979  1.0
  Lu  Lu2  1  0.00000000  0.81990642  0.08634979  1.0
  Lu  Lu3  1  0.00000000  0.18009358  0.91365021  1.0
  Lu  Lu4  1  0.00000000  0.94402927  0.37508367  1.0
  Lu  Lu5  1  0.00000000  0.05597073  0.62491633  1.0
  Lu  Lu6  1  0.00000000  0.44402927  0.12491633  1.0
  Lu  Lu7  1  0.00000000  0.55597073  0.87508367  1.0
  B  B8  1  0.50000000  0.55355546  0.43524879  1.0
  B  B9  1  0.50000000  0.44644454  0.56475121  1.0
  B  B10  1  0.50000000  0.05355546  0.06475121  1.0
  B  B11  1  0.50000000  0.94644454  0.93524879  1.0
  B  B12  1  0.50000000  0.74998430  0.42160068  1.0
  B  B13  1  0.50000000  0.25001570  0.57839932  1.0
  B  B14  1  0.50000000  0.24998430  0.07839932  1.0
  B  B15  1  0.50000000  0.75001570  0.92160068  1.0
  B  B16  1  0.50000000  0.79401659  0.26449756  1.0
  B  B17  1  0.50000000  0.20598341  0.73550244  1.0
  B  B18  1  0.50000000  0.29401659  0.23550244  1.0
  B  B19  1  0.50000000  0.70598341  0.76449756  1.0
  B  B20  1  0.50000000  0.63192982  0.18322499  1.0
  B  B21  1  0.50000000  0.36807018  0.81677501  1.0
  B  B22  1  0.50000000  0.13192982  0.31677501  1.0
  B  B23  1  0.50000000  0.86807018  0.68322499  1.0
  B  B24  1  0.50000000  0.98074838  0.21337025  1.0
  B  B25  1  0.50000000  0.01925162  0.78662975  1.0
  B  B26  1  0.50000000  0.48074838  0.28662975  1.0
  B  B27  1  0.50000000  0.51925162  0.71337025  1.0
  B  B28  1  0.50000000  0.60853152  0.02981116  1.0
  B  B29  1  0.50000000  0.39146848  0.97018884  1.0
  B  B30  1  0.50000000  0.10853152  0.47018884  1.0
  B  B31  1  0.50000000  0.89146848  0.52981116  1.0
  Ir  Ir32  1  0.00000000  0.63842735  0.32088691  1.0
  Ir  Ir33  1  0.00000000  0.36157265  0.67911309  1.0
  Ir  Ir34  1  0.00000000  0.13842735  0.17911309  1.0
  Ir  Ir35  1  0.00000000  0.86157265  0.82088691  1.0