# generated using pymatgen
data_SmNb5(B2Ru5)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.50785166
_cell_length_b   9.50785166
_cell_length_c   3.04729073
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.59575519
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SmNb5(B2Ru5)2
_chemical_formula_sum   'Sm1 Nb5 B4 Ru10'
_cell_volume   275.45788462
_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
  Sm  Sm0  1  0.82478735  0.67521265  0.00000000  1.0
  Nb  Nb1  1  0.17824024  0.32175976  0.00000000  1.0
  Nb  Nb2  1  0.32466224  0.82397608  0.00000000  1.0
  Nb  Nb3  1  0.67602392  0.17533776  0.00000000  1.0
  Nb  Nb4  1  0.50039970  0.50004528  0.00000000  1.0
  Nb  Nb5  1  0.99995472  0.99960030  0.00000000  1.0
  B  B6  1  0.61671560  0.88328440  0.00000000  1.0
  B  B7  1  0.37670627  0.12329373  0.00000000  1.0
  B  B8  1  0.12537708  0.61904662  0.00000000  1.0
  B  B9  1  0.88095338  0.37462292  0.00000000  1.0
  Ru  Ru10  1  0.55592787  0.72699796  0.50000000  1.0
  Ru  Ru11  1  0.42614541  0.28316639  0.50000000  1.0
  Ru  Ru12  1  0.08434498  0.78173687  0.50000000  1.0
  Ru  Ru13  1  0.93094561  0.21541519  0.50000000  1.0
  Ru  Ru14  1  0.28458481  0.56905439  0.50000000  1.0
  Ru  Ru15  1  0.71826313  0.41565502  0.50000000  1.0
  Ru  Ru16  1  0.21683361  0.07385459  0.50000000  1.0
  Ru  Ru17  1  0.77300204  0.94407213  0.50000000  1.0
  Ru  Ru18  1  0.49481001  0.00518999  0.50000000  1.0
  Ru  Ru19  1  0.01132302  0.48867698  0.50000000  1.0