# generated using pymatgen
data_Ru
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.68244189
_cell_length_b   5.06470533
_cell_length_c   45.75857907
_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   Ru36
_cell_volume   1085.17332387
_cell_formula_units_Z   36
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  0.332161  0.971324  0.311971  1
  Ru  Ru2  1  0.831912  0.112384  0.287824  1
  Ru  Ru3  1  0.168262  0.471324  0.311971  1
  Ru  Ru4  1  0.668510  0.612384  0.287824  1
  Ru  Ru5  1  0.333229  0.686693  0.362374  1
  Ru  Ru6  1  0.832794  0.830029  0.337438  1
  Ru  Ru7  1  0.167193  0.186693  0.362374  1
  Ru  Ru8  1  0.667628  0.330029  0.337438  1
  Ru  Ru9  1  0.333533  0.402276  0.412388  1
  Ru  Ru10  1  0.833619  0.544588  0.387371  1
  Ru  Ru11  1  0.166890  0.902276  0.412388  1
  Ru  Ru12  1  0.666803  0.044588  0.387371  1
  Ru  Ru13  1  0.333527  0.117664  0.462398  1
  Ru  Ru14  1  0.833518  0.259976  0.437389  1
  Ru  Ru15  1  0.166895  0.617664  0.462398  1
  Ru  Ru16  1  0.666904  0.759976  0.437389  1
  Ru  Ru17  1  0.333526  0.833058  0.512411  1
  Ru  Ru18  1  0.833526  0.975366  0.487403  1
  Ru  Ru19  1  0.166896  0.333058  0.512411  1
  Ru  Ru20  1  0.666896  0.475366  0.487403  1
  Ru  Ru21  1  0.333518  0.548448  0.562425  1
  Ru  Ru22  1  0.833527  0.690759  0.537416  1
  Ru  Ru23  1  0.166904  0.048448  0.562425  1
  Ru  Ru24  1  0.666895  0.190759  0.537416  1
  Ru  Ru25  1  0.333619  0.263836  0.612443  1
  Ru  Ru26  1  0.833533  0.406148  0.587426  1
  Ru  Ru27  1  0.166803  0.763836  0.612443  1
  Ru  Ru28  1  0.666890  0.906148  0.587426  1
  Ru  Ru29  1  0.332794  0.978394  0.662376  1
  Ru  Ru30  1  0.833229  0.121730  0.637440  1
  Ru  Ru31  1  0.167628  0.478394  0.662376  1
  Ru  Ru32  1  0.667193  0.621730  0.637440  1
  Ru  Ru33  1  0.331912  0.696040  0.711990  1
  Ru  Ru34  1  0.832161  0.837100  0.687843  1
  Ru  Ru35  1  0.168510  0.196040  0.711990  1
  Ru  Ru36  1  0.668262  0.337100  0.687843  1
