# generated using pymatgen
data_Zr3Nb3(B2Ru5)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.44996699
_cell_length_b   9.44996652
_cell_length_c   3.08313660
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   89.96353128
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr3Nb3(B2Ru5)2
_chemical_formula_sum   'Zr3 Nb3 B4 Ru10'
_cell_volume   275.32981327
_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
  Zr  Zr0  1  0.17520069  0.82479931  0.00000000  1.0
  Zr  Zr1  1  0.32424795  0.32494090  0.00000000  1.0
  Zr  Zr2  1  0.67505910  0.67575205  0.00000000  1.0
  Nb  Nb3  1  0.49952557  0.99975909  0.00000000  1.0
  Nb  Nb4  1  0.00024091  0.50047443  0.00000000  1.0
  Nb  Nb5  1  0.82392064  0.17607936  0.00000000  1.0
  B  B6  1  0.62198640  0.37801360  0.00000000  1.0
  B  B7  1  0.37941886  0.62058114  0.00000000  1.0
  B  B8  1  0.12082958  0.12169297  0.00000000  1.0
  B  B9  1  0.87830703  0.87917042  0.00000000  1.0
  Ru  Ru10  1  0.50143597  0.49856403  0.50000000  1.0
  Ru  Ru11  1  0.99614905  0.00385095  0.50000000  1.0
  Ru  Ru12  1  0.57551835  0.21678878  0.50000000  1.0
  Ru  Ru13  1  0.43015606  0.78075393  0.50000000  1.0
  Ru  Ru14  1  0.06701913  0.28060946  0.50000000  1.0
  Ru  Ru15  1  0.92882796  0.71969308  0.50000000  1.0
  Ru  Ru16  1  0.28030692  0.07117204  0.50000000  1.0
  Ru  Ru17  1  0.71939054  0.93298087  0.50000000  1.0
  Ru  Ru18  1  0.21924607  0.56984394  0.50000000  1.0
  Ru  Ru19  1  0.78321122  0.42448165  0.50000000  1.0