# generated using pymatgen
data_HfNb5(GaRu2)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.37389927
_cell_length_b   6.18454677
_cell_length_c   13.12152561
_cell_angle_alpha   89.99990780
_cell_angle_beta   90.00052485
_cell_angle_gamma   89.99973973
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfNb5(GaRu2)6
_chemical_formula_sum   'Hf1 Nb5 Ga6 Ru12'
_cell_volume   354.94493856
_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
  Hf  Hf0  1  0.50012505  0.49999940  0.83333010  1.0
  Nb  Nb1  1  0.00000259  0.00000400  0.99972384  1.0
  Nb  Nb2  1  0.49990453  0.49999269  0.16639730  1.0
  Nb  Nb3  1  0.99987672  0.00000337  0.33335265  1.0
  Nb  Nb4  1  0.49999157  0.49999832  0.50030701  1.0
  Nb  Nb5  1  0.00010887  0.00000064  0.66692021  1.0
  Ga  Ga6  1  0.00000505  0.49999788  0.99953151  1.0
  Ga  Ga7  1  0.49988930  0.00000351  0.16735315  1.0
  Ga  Ga8  1  0.99983483  0.49999043  0.33327845  1.0
  Ga  Ga9  1  0.49999701  0.00000724  0.49933978  1.0
  Ga  Ga10  1  0.00010925  0.49999647  0.66718258  1.0
  Ga  Ga11  1  0.50015873  0.00000571  0.83327304  1.0
  Ru  Ru12  1  0.50000346  0.24801960  0.00236899  1.0
  Ru  Ru13  1  0.50000122  0.75198353  0.00236857  1.0
  Ru  Ru14  1  0.99988939  0.25038643  0.16754469  1.0
  Ru  Ru15  1  0.99988600  0.74960898  0.16754514  1.0
  Ru  Ru16  1  0.49986906  0.24983487  0.33336874  1.0
  Ru  Ru17  1  0.49986572  0.75015908  0.33337074  1.0
  Ru  Ru18  1  0.99999840  0.25042313  0.49915625  1.0
  Ru  Ru19  1  0.99999538  0.74957553  0.49915693  1.0
  Ru  Ru20  1  0.50011971  0.24804825  0.66426703  1.0
  Ru  Ru21  1  0.50011705  0.75195243  0.66426560  1.0
  Ru  Ru22  1  0.00012766  0.24505777  0.83330039  1.0
  Ru  Ru23  1  0.00012746  0.75494574  0.83329930  1.0