# generated using pymatgen
data_Ti2SiB2Ru5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.09581465
_cell_length_b   9.09581465
_cell_length_c   2.95340256
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti2SiB2Ru5
_chemical_formula_sum   'Ti4 Si2 B4 Ru10'
_cell_volume   244.34634731
_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  0.17491394  0.67491394  0.00000000  1.0
  Ti  Ti1  1  0.67491394  0.82508606  0.00000000  1.0
  Ti  Ti2  1  0.32508606  0.17491394  0.00000000  1.0
  Ti  Ti3  1  0.82508606  0.32508606  0.00000000  1.0
  Si  Si4  1  0.00000000  0.00000000  0.00000000  1.0
  Si  Si5  1  0.50000000  0.50000000  0.00000000  1.0
  B  B6  1  0.37441936  0.87441936  0.00000000  1.0
  B  B7  1  0.87441936  0.62558064  0.00000000  1.0
  B  B8  1  0.12558064  0.37441936  0.00000000  1.0
  B  B9  1  0.62558064  0.12558064  0.00000000  1.0
  Ru  Ru10  1  0.00000000  0.50000000  0.50000000  1.0
  Ru  Ru11  1  0.50000000  0.00000000  0.50000000  1.0
  Ru  Ru12  1  0.29049880  0.42880828  0.50000000  1.0
  Ru  Ru13  1  0.70950220  0.57119172  0.50000000  1.0
  Ru  Ru14  1  0.57119172  0.29049880  0.50000000  1.0
  Ru  Ru15  1  0.42880828  0.70950220  0.50000000  1.0
  Ru  Ru16  1  0.92880828  0.79049780  0.50000000  1.0
  Ru  Ru17  1  0.79049780  0.07119172  0.50000000  1.0
  Ru  Ru18  1  0.20950120  0.92880828  0.50000000  1.0
  Ru  Ru19  1  0.07119172  0.20950120  0.50000000  1.0