# generated using pymatgen
data_Ta3Ru
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.55134337
_cell_length_b   4.55134409
_cell_length_c   4.55134625
_cell_angle_alpha   60.00001573
_cell_angle_beta   59.99998952
_cell_angle_gamma   59.99999476
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta3Ru
_chemical_formula_sum   'Ta3 Ru1'
_cell_volume   66.66596203
_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  0.00000000  0.00000000  -0.00000000  1.0
  Ta  Ta1  1  0.49999900  0.49999900  0.49999900  1.0
  Ta  Ta2  1  0.25000000  0.25000000  0.25000000  1.0
  Ru  Ru3  1  0.74999900  0.74999900  0.74999900  1.0