# generated using pymatgen
data_Zr2NbB2Ru5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.46494170
_cell_length_b   9.46494170
_cell_length_c   3.09842887
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr2NbB2Ru5
_chemical_formula_sum   'Zr4 Nb2 B4 Ru10'
_cell_volume   277.57312680
_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
  Zr  Zr0  1  0.67542061  0.17542061  0.00000000  1.0
  Zr  Zr1  1  0.32457939  0.82457939  0.00000000  1.0
  Zr  Zr2  1  0.17542061  0.32457939  0.00000000  1.0
  Zr  Zr3  1  0.82457939  0.67542061  0.00000000  1.0
  Nb  Nb4  1  0.00000000  0.00000000  0.00000000  1.0
  Nb  Nb5  1  0.50000000  0.50000000  0.00000000  1.0
  B  B6  1  0.12099546  0.62099546  0.00000000  1.0
  B  B7  1  0.87900454  0.37900454  0.00000000  1.0
  B  B8  1  0.62099546  0.87900454  0.00000000  1.0
  B  B9  1  0.37900454  0.12099546  0.00000000  1.0
  Ru  Ru10  1  0.21835128  0.07101437  0.50000000  1.0
  Ru  Ru11  1  0.78164872  0.92898563  0.50000000  1.0
  Ru  Ru12  1  0.07101437  0.78164872  0.50000000  1.0
  Ru  Ru13  1  0.71835128  0.42898563  0.50000000  1.0
  Ru  Ru14  1  0.92898563  0.21835128  0.50000000  1.0
  Ru  Ru15  1  0.28164872  0.57101437  0.50000000  1.0
  Ru  Ru16  1  0.57101437  0.71835128  0.50000000  1.0
  Ru  Ru17  1  0.42898563  0.28164872  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