# generated using pymatgen
data_Ru
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.69860656
_cell_length_b   4.28233715
_cell_length_c   46.91436766
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ru
_chemical_formula_sum   Ru18
_cell_volume   542.158530082
_cell_formula_units_Z   18
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
  Ru  Ru1  1  0.751101  0.250627  0.290908  1
  Ru  Ru2  1  0.251101  0.750627  0.307572  1
  Ru  Ru3  1  0.251101  0.250627  0.340804  1
  Ru  Ru4  1  0.751101  0.750627  0.357725  1
  Ru  Ru5  1  0.751101  0.250627  0.390886  1
  Ru  Ru6  1  0.251101  0.750627  0.407652  1
  Ru  Ru7  1  0.251101  0.250627  0.440899  1
  Ru  Ru8  1  0.751101  0.750627  0.457624  1
  Ru  Ru9  1  0.751101  0.250627  0.490895  1
  Ru  Ru10  1  0.251101  0.750627  0.507609  1
  Ru  Ru11  1  0.251101  0.250627  0.540880  1
  Ru  Ru12  1  0.751101  0.750627  0.557605  1
  Ru  Ru13  1  0.751101  0.250627  0.590852  1
  Ru  Ru14  1  0.251101  0.750627  0.607618  1
  Ru  Ru15  1  0.251101  0.250627  0.640779  1
  Ru  Ru16  1  0.751101  0.750627  0.657700  1
  Ru  Ru17  1  0.751101  0.250627  0.690932  1
  Ru  Ru18  1  0.251101  0.750627  0.707596  1
