# generated using pymatgen
data_Nb2AlB2Ru5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.26421551
_cell_length_b   9.26421551
_cell_length_c   2.99002728
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb2AlB2Ru5
_chemical_formula_sum   'Nb4 Al2 B4 Ru10'
_cell_volume   256.62115114
_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
  Nb  Nb0  1  0.82301508  0.67698492  0.00000000  1.0
  Nb  Nb1  1  0.17698492  0.32301508  0.00000000  1.0
  Nb  Nb2  1  0.32301508  0.82301508  0.00000000  1.0
  Nb  Nb3  1  0.67698492  0.17698492  0.00000000  1.0
  Al  Al4  1  0.50000000  0.50000000  0.00000000  1.0
  Al  Al5  1  0.00000000  0.00000000  0.00000000  1.0
  B  B6  1  0.62458481  0.87541519  0.00000000  1.0
  B  B7  1  0.37541519  0.12458481  0.00000000  1.0
  B  B8  1  0.12458481  0.62458481  0.00000000  1.0
  B  B9  1  0.87541519  0.37541519  0.00000000  1.0
  Ru  Ru10  1  0.56946129  0.71500254  0.50000000  1.0
  Ru  Ru11  1  0.43053871  0.28499746  0.50000000  1.0
  Ru  Ru12  1  0.06946129  0.78499746  0.50000000  1.0
  Ru  Ru13  1  0.93053871  0.21500254  0.50000000  1.0
  Ru  Ru14  1  0.28499746  0.56946129  0.50000000  1.0
  Ru  Ru15  1  0.71500254  0.43053871  0.50000000  1.0
  Ru  Ru16  1  0.21500254  0.06946129  0.50000000  1.0
  Ru  Ru17  1  0.78499746  0.93053871  0.50000000  1.0
  Ru  Ru18  1  0.50000000  0.00000000  0.50000000  1.0
  Ru  Ru19  1  0.00000000  0.50000000  0.50000000  1.0