# generated using pymatgen
data_Nd(BIr)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.53899715
_cell_length_b   6.53899715
_cell_length_c   8.41871731
_cell_angle_alpha   112.90495942
_cell_angle_beta   112.90495942
_cell_angle_gamma   89.87562575
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd(BIr)2
_chemical_formula_sum   'Nd4 B8 Ir8'
_cell_volume   300.67733354
_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
  Nd  Nd0  1  0.62500000  0.87500000  0.75000000  1.0
  Nd  Nd1  1  0.12500000  0.87500000  0.75000000  1.0
  Nd  Nd2  1  0.12500000  0.37500000  0.25000000  1.0
  Nd  Nd3  1  0.12500000  0.87500000  0.25000000  1.0
  B  B4  1  0.39284000  0.25345000  0.78482200  1.0
  B  B5  1  0.39198200  0.53137300  0.78482200  1.0
  B  B6  1  0.74655000  0.60716000  0.21517800  1.0
  B  B7  1  0.85716000  0.49655000  0.71517800  1.0
  B  B8  1  0.46862700  0.60801800  0.21517800  1.0
  B  B9  1  0.85801800  0.21862700  0.71517800  1.0
  B  B10  1  0.50345000  0.14284000  0.28482200  1.0
  B  B11  1  0.78137300  0.14198200  0.28482200  1.0
  Ir  Ir12  1  0.18136200  0.46924700  0.93741300  1.0
  Ir  Ir13  1  0.75605000  0.46816600  0.93741300  1.0
  Ir  Ir14  1  0.53075300  0.81863800  0.06258700  1.0
  Ir  Ir15  1  0.06863800  0.28075300  0.56258700  1.0
  Ir  Ir16  1  0.53183400  0.24395000  0.06258700  1.0
  Ir  Ir17  1  0.49395000  0.28183400  0.56258700  1.0
  Ir  Ir18  1  0.71924700  0.93136200  0.43741300  1.0
  Ir  Ir19  1  0.71816600  0.50605000  0.43741300  1.0