# generated using pymatgen
data_Ta5Be(B2Ru5)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.22423110
_cell_length_b   9.22423110
_cell_length_c   3.00778378
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta5Be(B2Ru5)2
_chemical_formula_sum   'Ta5 Be1 B4 Ru10'
_cell_volume   255.92161227
_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
  Ta  Ta0  1  0.81719276  0.67277586  0.00000000  1.0
  Ta  Ta1  1  0.18280724  0.32722414  0.00000000  1.0
  Ta  Ta2  1  0.32722414  0.81719276  0.00000000  1.0
  Ta  Ta3  1  0.67277586  0.18280724  0.00000000  1.0
  Ta  Ta4  1  0.00000000  0.00000000  0.00000000  1.0
  Be  Be5  1  0.50000000  0.50000000  0.00000000  1.0
  B  B6  1  0.61352047  0.86484389  0.00000000  1.0
  B  B7  1  0.38647953  0.13515611  0.00000000  1.0
  B  B8  1  0.13515611  0.61352047  0.00000000  1.0
  B  B9  1  0.86484389  0.38647953  0.00000000  1.0
  Ru  Ru10  1  0.56521429  0.70821152  0.50000000  1.0
  Ru  Ru11  1  0.43478571  0.29178848  0.50000000  1.0
  Ru  Ru12  1  0.07507737  0.78017389  0.50000000  1.0
  Ru  Ru13  1  0.92492263  0.21982611  0.50000000  1.0
  Ru  Ru14  1  0.29178848  0.56521429  0.50000000  1.0
  Ru  Ru15  1  0.70821152  0.43478571  0.50000000  1.0
  Ru  Ru16  1  0.21982611  0.07507737  0.50000000  1.0
  Ru  Ru17  1  0.78017389  0.92492263  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