# generated using pymatgen
data_LiBe5(SiRu2)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.03557895
_cell_length_b   5.70933604
_cell_length_c   12.10837019
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00071629
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiBe5(SiRu2)6
_chemical_formula_sum   'Li1 Be5 Si6 Ru12'
_cell_volume   278.98261673
_cell_formula_units_Z   1
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
  Li  Li0  1  0.00000000  0.50000100  0.00000000  1.0
  Be  Be1  1  0.49987843  0.00000000  0.16822383  1.0
  Be  Be2  1  0.99984441  0.50000100  0.33414768  1.0
  Be  Be3  1  0.50000000  0.00000000  0.50000000  1.0
  Be  Be4  1  0.00015659  0.50000100  0.66585232  1.0
  Be  Be5  1  0.50012157  0.00000000  0.83177617  1.0
  Si  Si6  1  0.00000000  0.00000000  0.00000000  1.0
  Si  Si7  1  0.49987916  0.50000100  0.16326217  1.0
  Si  Si8  1  0.99989567  0.00000000  0.33503007  1.0
  Si  Si9  1  0.50000000  0.50000100  0.50000000  1.0
  Si  Si10  1  0.00010533  0.00000000  0.66496993  1.0
  Si  Si11  1  0.50012084  0.50000100  0.83673883  1.0
  Ru  Ru12  1  0.50000000  0.24169266  0.00000000  1.0
  Ru  Ru13  1  0.50000000  0.75830734  0.00000000  1.0
  Ru  Ru14  1  0.99989538  0.24667851  0.17078599  1.0
  Ru  Ru15  1  0.99989538  0.75332149  0.17078599  1.0
  Ru  Ru16  1  0.49990632  0.25115047  0.33353804  1.0
  Ru  Ru17  1  0.49990632  0.74885053  0.33353804  1.0
  Ru  Ru18  1  0.00000000  0.25025035  0.50000000  1.0
  Ru  Ru19  1  0.00000000  0.74974965  0.50000000  1.0
  Ru  Ru20  1  0.50009468  0.25115047  0.66646196  1.0
  Ru  Ru21  1  0.50009468  0.74885053  0.66646196  1.0
  Ru  Ru22  1  0.00010462  0.24667851  0.82921401  1.0
  Ru  Ru23  1  0.00010462  0.75332149  0.82921401  1.0