# generated using pymatgen
data_Nb2SnB2Ru5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.46315631
_cell_length_b   9.46315631
_cell_length_c   3.00943252
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb2SnB2Ru5
_chemical_formula_sum   'Nb4 Sn2 B4 Ru10'
_cell_volume   269.49867695
_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  0.82321847  0.67678153  0.00000000  1.0
  Nb  Nb1  1  0.17678153  0.32321847  0.00000000  1.0
  Nb  Nb2  1  0.32321847  0.82321847  0.00000000  1.0
  Nb  Nb3  1  0.67678153  0.17678153  0.00000000  1.0
  Sn  Sn4  1  0.50000000  0.50000000  0.00000000  1.0
  Sn  Sn5  1  0.00000000  0.00000000  0.00000000  1.0
  B  B6  1  0.62141391  0.87858609  0.00000000  1.0
  B  B7  1  0.37858609  0.12141391  0.00000000  1.0
  B  B8  1  0.12141391  0.62141391  0.00000000  1.0
  B  B9  1  0.87858609  0.37858609  0.00000000  1.0
  Ru  Ru10  1  0.57037489  0.72176363  0.50000000  1.0
  Ru  Ru11  1  0.42962511  0.27823637  0.50000000  1.0
  Ru  Ru12  1  0.07037489  0.77823637  0.50000000  1.0
  Ru  Ru13  1  0.92962511  0.22176363  0.50000000  1.0
  Ru  Ru14  1  0.27823637  0.57037489  0.50000000  1.0
  Ru  Ru15  1  0.72176363  0.42962511  0.50000000  1.0
  Ru  Ru16  1  0.22176363  0.07037489  0.50000000  1.0
  Ru  Ru17  1  0.77823637  0.92962511  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