# generated using pymatgen
data_Ru
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.69663970
_cell_length_b   13.12955647
_cell_length_c   46.15051961
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   84.09503873
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ru
_chemical_formula_sum   Ru54
_cell_volume   1625.32058167
_cell_formula_units_Z   54
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  0.804266  0.894376  0.295062  1
  Ru  Ru2  1  0.642908  0.217135  0.311528  1
  Ru  Ru3  1  0.965879  0.571218  0.278704  1
  Ru  Ru4  1  0.228874  0.045194  0.319995  1
  Ru  Ru5  1  0.552152  0.398767  0.287114  1
  Ru  Ru6  1  0.390329  0.722264  0.303440  1
  Ru  Ru7  1  0.320324  0.862283  0.344961  1
  Ru  Ru8  1  0.159265  0.184399  0.361688  1
  Ru  Ru9  1  0.481722  0.539520  0.328431  1
  Ru  Ru10  1  0.745235  0.012468  0.370218  1
  Ru  Ru11  1  0.067827  0.367330  0.336911  1
  Ru  Ru12  1  0.906449  0.690056  0.353608  1
  Ru  Ru13  1  0.836496  0.829947  0.395078  1
  Ru  Ru14  1  0.675213  0.152498  0.411752  1
  Ru  Ru15  1  0.997845  0.507257  0.378451  1
  Ru  Ru16  1  0.261239  0.980449  0.420184  1
  Ru  Ru17  1  0.583975  0.335014  0.386764  1
  Ru  Ru18  1  0.422554  0.657839  0.403533  1
  Ru  Ru19  1  0.352578  0.797789  0.445107  1
  Ru  Ru20  1  0.191253  0.120411  0.461777  1
  Ru  Ru21  1  0.513935  0.475064  0.428429  1
  Ru  Ru22  1  0.777280  0.948366  0.470175  1
  Ru  Ru23  1  0.099952  0.303061  0.436799  1
  Ru  Ru24  1  0.938623  0.625689  0.453504  1
  Ru  Ru25  1  0.868629  0.765680  0.495111  1
  Ru  Ru26  1  0.707298  0.088312  0.511793  1
  Ru  Ru27  1  0.029962  0.443014  0.478437  1
  Ru  Ru28  1  0.293323  0.916280  0.520174  1
  Ru  Ru29  1  0.615988  0.270981  0.486818  1
  Ru  Ru30  1  0.454657  0.593614  0.503499  1
  Ru  Ru31  1  0.384662  0.733605  0.545107  1
  Ru  Ru32  1  0.223334  0.056233  0.561812  1
  Ru  Ru33  1  0.546006  0.410928  0.528436  1
  Ru  Ru34  1  0.809351  0.884229  0.570181  1
  Ru  Ru35  1  0.132033  0.238883  0.536834  1
  Ru  Ru36  1  0.970708  0.561505  0.553504  1
  Ru  Ru37  1  0.900732  0.701455  0.595078  1
  Ru  Ru38  1  0.739310  0.024280  0.611846  1
  Ru  Ru39  1  0.062047  0.378844  0.578427  1
  Ru  Ru40  1  0.325441  0.852037  0.620160  1
  Ru  Ru41  1  0.648072  0.206796  0.586859  1
  Ru  Ru42  1  0.486789  0.529347  0.603533  1
  Ru  Ru43  1  0.416837  0.669238  0.645002  1
  Ru  Ru44  1  0.255459  0.991964  0.661700  1
  Ru  Ru45  1  0.578051  0.346826  0.628393  1
  Ru  Ru46  1  0.841563  0.819773  0.670179  1
  Ru  Ru47  1  0.164020  0.174895  0.636922  1
  Ru  Ru48  1  0.002962  0.497011  0.653650  1
  Ru  Ru49  1  0.932956  0.637030  0.695171  1
  Ru  Ru50  1  0.771134  0.960527  0.711497  1
  Ru  Ru51  1  0.094412  0.314100  0.678616  1
  Ru  Ru52  1  0.357406  0.788076  0.719907  1
  Ru  Ru53  1  0.680378  0.142159  0.687083  1
  Ru  Ru54  1  0.519020  0.464918  0.703548  1
