# generated using pymatgen
data_YB4Ru
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.55533644
_cell_length_b   5.95086681
_cell_length_c   11.51054132
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YB4Ru
_chemical_formula_sum   'Y4 B16 Ru4'
_cell_volume   243.53236284
_cell_formula_units_Z   4
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
  Y  Y0  1  0.00000000  0.62905173  0.34998852  1.0
  Y  Y1  1  0.00000000  0.37094827  0.65001148  1.0
  Y  Y2  1  -0.00000000  0.12905173  0.15001148  1.0
  Y  Y3  1  0.00000000  0.87094827  0.84998852  1.0
  B  B4  1  0.50000000  0.78879729  0.18510381  1.0
  B  B5  1  0.50000000  0.21120271  0.81489619  1.0
  B  B6  1  0.50000000  0.28879729  0.31489619  1.0
  B  B7  1  0.50000000  0.71120271  0.68510381  1.0
  B  B8  1  0.50000000  0.86333672  0.03018309  1.0
  B  B9  1  0.50000000  0.13666328  0.96981691  1.0
  B  B10  1  0.50000000  0.36333672  0.46981691  1.0
  B  B11  1  0.50000000  0.63666328  0.53018309  1.0
  B  B12  1  0.50000000  0.88831255  0.45338712  1.0
  B  B13  1  0.50000000  0.11168745  0.54661288  1.0
  B  B14  1  0.50000000  0.38831255  0.04661288  1.0
  B  B15  1  0.50000000  0.61168745  0.95338712  1.0
  B  B16  1  0.50000000  0.97647767  0.30865738  1.0
  B  B17  1  0.50000000  0.02352233  0.69134262  1.0
  B  B18  1  0.50000000  0.47647767  0.19134262  1.0
  B  B19  1  0.50000000  0.52352233  0.80865738  1.0
  Ru  Ru20  1  0.00000000  0.64026095  0.09242028  1.0
  Ru  Ru21  1  -0.00000000  0.35973905  0.90757972  1.0
  Ru  Ru22  1  0.00000000  0.14026095  0.40757972  1.0
  Ru  Ru23  1  -0.00000000  0.85973905  0.59242028  1.0