# generated using pymatgen
data_NaNd(BIr)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.06669212
_cell_length_b   6.11237170
_cell_length_c   5.50044222
_cell_angle_alpha   74.75777935
_cell_angle_beta   56.56677838
_cell_angle_gamma   48.67543706
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaNd(BIr)4
_chemical_formula_sum   'Na1 Nd1 B4 Ir4'
_cell_volume   146.95665856
_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
  Na  Na0  1  0.50000000  0.50000000  0.50000000  1.0
  Nd  Nd1  1  0.75000000  0.75000000  0.75000000  1.0
  B  B2  1  0.17950284  0.82049716  0.17950284  1.0
  B  B3  1  0.07462712  0.42537288  0.07462712  1.0
  B  B4  1  0.82049716  0.17950284  0.82049716  1.0
  B  B5  1  0.42537288  0.07462712  0.42537288  1.0
  Ir  Ir6  1  0.87110192  0.87110192  0.12889808  1.0
  Ir  Ir7  1  0.12889808  0.12889808  0.87110192  1.0
  Ir  Ir8  1  0.38206739  0.38206739  0.11793261  1.0
  Ir  Ir9  1  0.11793261  0.11793261  0.38206739  1.0