# generated using pymatgen
data_TaNb2B2Ru5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.43483685
_cell_length_b   9.43483685
_cell_length_c   3.00173844
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaNb2B2Ru5
_chemical_formula_sum   'Ta2 Nb4 B4 Ru10'
_cell_volume   267.20318808
_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
  Ta  Ta0  1  0.50000000  0.50000000  0.00000000  1.0
  Ta  Ta1  1  0.00000000  0.00000000  0.00000000  1.0
  Nb  Nb2  1  0.82372968  0.67627032  0.00000000  1.0
  Nb  Nb3  1  0.17627032  0.32372968  0.00000000  1.0
  Nb  Nb4  1  0.32372968  0.82372968  0.00000000  1.0
  Nb  Nb5  1  0.67627032  0.17627032  0.00000000  1.0
  B  B6  1  0.62098342  0.87901658  0.00000000  1.0
  B  B7  1  0.37901658  0.12098342  0.00000000  1.0
  B  B8  1  0.12098342  0.62098342  0.00000000  1.0
  B  B9  1  0.87901658  0.37901658  0.00000000  1.0
  Ru  Ru10  1  0.57088612  0.71867674  0.50000000  1.0
  Ru  Ru11  1  0.42911388  0.28132326  0.50000000  1.0
  Ru  Ru12  1  0.07088612  0.78132326  0.50000000  1.0
  Ru  Ru13  1  0.92911388  0.21867674  0.50000000  1.0
  Ru  Ru14  1  0.28132326  0.57088612  0.50000000  1.0
  Ru  Ru15  1  0.71867674  0.42911388  0.50000000  1.0
  Ru  Ru16  1  0.21867674  0.07088612  0.50000000  1.0
  Ru  Ru17  1  0.78132326  0.92911388  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