# generated using pymatgen
data_Ta5Al(B2Ru5)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.00268416
_cell_length_b   9.30722372
_cell_length_c   9.30722372
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta5Al(B2Ru5)2
_chemical_formula_sum   'Ta5 Al1 B4 Ru10'
_cell_volume   260.10575359
_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  0.00000000  0.67390342  0.81946781  1.0
  Ta  Ta1  1  0.00000000  0.32609658  0.18053219  1.0
  Ta  Ta2  1  0.00000000  0.81946781  0.32609658  1.0
  Ta  Ta3  1  0.00000000  0.18053219  0.67390342  1.0
  Ta  Ta4  1  0.00000000  0.00000000  0.00000000  1.0
  Al  Al5  1  0.00000000  0.50000000  0.50000000  1.0
  B  B6  1  0.00000000  0.87087895  0.61680665  1.0
  B  B7  1  0.00000000  0.12912105  0.38319335  1.0
  B  B8  1  0.00000000  0.61680665  0.12912105  1.0
  B  B9  1  0.00000000  0.38319335  0.87087895  1.0
  Ru  Ru10  1  0.50000000  0.71387788  0.56948882  1.0
  Ru  Ru11  1  0.50000000  0.28612212  0.43051118  1.0
  Ru  Ru12  1  0.50000000  0.78088918  0.07229485  1.0
  Ru  Ru13  1  0.50000000  0.21911082  0.92770515  1.0
  Ru  Ru14  1  0.50000000  0.56948882  0.28612212  1.0
  Ru  Ru15  1  0.50000000  0.43051118  0.71387788  1.0
  Ru  Ru16  1  0.50000000  0.07229485  0.21911082  1.0
  Ru  Ru17  1  0.50000000  0.92770515  0.78088918  1.0
  Ru  Ru18  1  0.50000000  0.00000000  0.50000000  1.0
  Ru  Ru19  1  0.50000000  0.50000000  0.00000000  1.0