# generated using pymatgen
data_Ti2AlB2Ru5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.13693276
_cell_length_b   9.13693276
_cell_length_c   2.98265753
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti2AlB2Ru5
_chemical_formula_sum   'Ti4 Al2 B4 Ru10'
_cell_volume   249.00281001
_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
  Ti  Ti0  1  0.67520422  0.17520422  0.00000000  1.0
  Ti  Ti1  1  0.32479578  0.82479578  0.00000000  1.0
  Ti  Ti2  1  0.17520422  0.32479578  0.00000000  1.0
  Ti  Ti3  1  0.82479578  0.67520422  0.00000000  1.0
  Al  Al4  1  0.00000000  0.00000000  0.00000000  1.0
  Al  Al5  1  0.50000000  0.50000000  0.00000000  1.0
  B  B6  1  0.12604322  0.62604322  0.00000000  1.0
  B  B7  1  0.87395678  0.37395678  0.00000000  1.0
  B  B8  1  0.62604322  0.87395678  0.00000000  1.0
  B  B9  1  0.37395678  0.12604322  0.00000000  1.0
  Ru  Ru10  1  0.21342633  0.07180520  0.50000000  1.0
  Ru  Ru11  1  0.78657367  0.92819480  0.50000000  1.0
  Ru  Ru12  1  0.07180520  0.78657367  0.50000000  1.0
  Ru  Ru13  1  0.71342633  0.42819480  0.50000000  1.0
  Ru  Ru14  1  0.92819480  0.21342633  0.50000000  1.0
  Ru  Ru15  1  0.28657367  0.57180520  0.50000000  1.0
  Ru  Ru16  1  0.57180520  0.71342633  0.50000000  1.0
  Ru  Ru17  1  0.42819480  0.28657367  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