# generated using pymatgen
data_Ta3Be8Ru
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.52129951
_cell_length_b   4.52129964
_cell_length_c   7.39858189
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000635
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta3Be8Ru
_chemical_formula_sum   'Ta3 Be8 Ru1'
_cell_volume   130.98020222
_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
  Ta  Ta0  1  0.66666700  0.33333300  0.05695400  1.0
  Ta  Ta1  1  0.66666700  0.33333300  0.43290614  1.0
  Ta  Ta2  1  0.33333300  0.66666700  0.57327256  1.0
  Be  Be3  1  0.00000000  0.00000000  0.50292207  1.0
  Be  Be4  1  0.00000000  0.00000000  0.00022003  1.0
  Be  Be5  1  0.65992763  0.82996282  0.24756883  1.0
  Be  Be6  1  0.17003718  0.82996282  0.24756883  1.0
  Be  Be7  1  0.17003718  0.34007237  0.24756883  1.0
  Be  Be8  1  0.33995008  0.16997554  0.75210825  1.0
  Be  Be9  1  0.83002446  0.16997554  0.75210825  1.0
  Be  Be10  1  0.83002446  0.66004992  0.75210825  1.0
  Ru  Ru11  1  0.33333300  0.66666700  0.93469595  1.0