# generated using pymatgen
data_Ti2FeB2Ru5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.11254135
_cell_length_b   9.11254135
_cell_length_c   2.97456415
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti2FeB2Ru5
_chemical_formula_sum   'Ti4 Fe2 B4 Ru10'
_cell_volume   247.00307694
_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  0.67518917  0.17518917  0.00000000  1.0
  Ti  Ti1  1  0.32481083  0.82481083  0.00000000  1.0
  Ti  Ti2  1  0.17518917  0.32481083  0.00000000  1.0
  Ti  Ti3  1  0.82481083  0.67518917  0.00000000  1.0
  Fe  Fe4  1  0.00000000  0.00000000  0.00000000  1.0
  Fe  Fe5  1  0.50000000  0.50000000  0.00000000  1.0
  B  B6  1  0.12497583  0.62497583  0.00000000  1.0
  B  B7  1  0.87502417  0.37502417  0.00000000  1.0
  B  B8  1  0.62497583  0.87502417  0.00000000  1.0
  B  B9  1  0.37502417  0.12497583  0.00000000  1.0
  Ru  Ru10  1  0.21122536  0.07359364  0.50000000  1.0
  Ru  Ru11  1  0.78877464  0.92640636  0.50000000  1.0
  Ru  Ru12  1  0.07359364  0.78877464  0.50000000  1.0
  Ru  Ru13  1  0.71122536  0.42640636  0.50000000  1.0
  Ru  Ru14  1  0.92640636  0.21122536  0.50000000  1.0
  Ru  Ru15  1  0.28877464  0.57359364  0.50000000  1.0
  Ru  Ru16  1  0.57359364  0.71122536  0.50000000  1.0
  Ru  Ru17  1  0.42640636  0.28877464  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