# generated using pymatgen
data_LuNi(BIr)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.10864174
_cell_length_b   5.10864150
_cell_length_c   3.15965233
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   116.25051399
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LuNi(BIr)2
_chemical_formula_sum   'Lu1 Ni1 B2 Ir2'
_cell_volume   73.95696431
_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
  Lu  Lu0  1  0.00000000  0.00000000  0.50000000  1.0
  Ni  Ni1  1  0.50000000  0.50000000  0.00000000  1.0
  B  B2  1  0.65733087  0.34266913  0.50000000  1.0
  B  B3  1  0.34266913  0.65733087  0.50000000  1.0
  Ir  Ir4  1  0.00000000  0.50000000  0.00000000  1.0
  Ir  Ir5  1  0.50000000  0.00000000  0.00000000  1.0