# generated using pymatgen
data_NdB2IrRu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.90136066
_cell_length_b   6.03392707
_cell_length_c   5.58216510
_cell_angle_alpha   72.78239832
_cell_angle_beta   56.62934959
_cell_angle_gamma   50.58824079
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NdB2IrRu
_chemical_formula_sum   'Nd2 B4 Ir2 Ru2'
_cell_volume   149.47394420
_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  0.00000000  0.00000000  0.00000000  1.0
  Nd  Nd1  1  0.25000000  0.25000000  0.25000000  1.0
  B  B2  1  0.31659142  0.68340858  0.31659142  1.0
  B  B3  1  0.68340858  0.31659142  0.68340858  1.0
  B  B4  1  0.57409082  0.92590918  0.57409082  1.0
  B  B5  1  0.92590918  0.57409082  0.92590918  1.0
  Ir  Ir6  1  0.63393386  0.63393386  0.36606614  1.0
  Ir  Ir7  1  0.36606614  0.36606614  0.63393386  1.0
  Ru  Ru8  1  0.61519812  0.61519812  0.88480188  1.0
  Ru  Ru9  1  0.88480188  0.88480188  0.61519812  1.0