# generated using pymatgen
data_Nb2BIrRu5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.61714405
_cell_length_b   5.60482421
_cell_length_c   5.60482367
_cell_angle_alpha   60.14548229
_cell_angle_beta   59.92725931
_cell_angle_gamma   59.92725738
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb2BIrRu5
_chemical_formula_sum   'Nb2 B1 Ir1 Ru5'
_cell_volume   124.77291019
_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
  Nb  Nb0  1  0.25016739  0.24983261  0.24983261  1.0
  Nb  Nb1  1  0.75016739  0.74983261  0.74983261  1.0
  B  B2  1  0.49728652  0.50271348  0.50271348  1.0
  Ir  Ir3  1  0.75925998  0.24074002  0.24074002  1.0
  Ru  Ru4  1  0.24197920  0.75802080  0.24057791  1.0
  Ru  Ru5  1  0.75942209  0.75802080  0.24057791  1.0
  Ru  Ru6  1  0.24197920  0.24057791  0.75802080  1.0
  Ru  Ru7  1  0.75942209  0.24057791  0.75802080  1.0
  Ru  Ru8  1  0.24031714  0.75968286  0.75968286  1.0