# generated using pymatgen
data_Nd(BIr)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.97359550
_cell_length_b   7.67781586
_cell_length_c   7.67781586
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd(BIr)4
_chemical_formula_sum   'Nd2 B8 Ir8'
_cell_volume   234.23891071
_cell_formula_units_Z   2
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
  Nd  Nd0  1  0.25000000  0.75000000  0.75000000  1.0
  Nd  Nd1  1  0.75000000  0.25000000  0.25000000  1.0
  B  B2  1  0.85750651  0.02904488  0.90801301  1.0
  B  B3  1  0.14249349  0.52904488  0.40801301  1.0
  B  B4  1  0.35750651  0.09198699  0.52904488  1.0
  B  B5  1  0.35750651  0.40801301  0.97095512  1.0
  B  B6  1  0.85750651  0.47095512  0.59198699  1.0
  B  B7  1  0.14249349  0.97095512  0.09198699  1.0
  B  B8  1  0.64249349  0.90801301  0.47095512  1.0
  B  B9  1  0.64249349  0.59198699  0.02904488  1.0
  Ir  Ir10  1  0.35827685  0.35924810  0.59053568  1.0
  Ir  Ir11  1  0.35827685  0.14075190  0.90946432  1.0
  Ir  Ir12  1  0.85827685  0.40946432  0.85924810  1.0
  Ir  Ir13  1  0.14172315  0.90946432  0.35924810  1.0
  Ir  Ir14  1  0.64172315  0.64075190  0.40946432  1.0
  Ir  Ir15  1  0.64172315  0.85924810  0.09053568  1.0
  Ir  Ir16  1  0.14172315  0.59053568  0.14075190  1.0
  Ir  Ir17  1  0.85827685  0.09053568  0.64075190  1.0