# generated using pymatgen
data_LuHf5(SnRu2)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.53611739
_cell_length_b   6.41679110
_cell_length_c   13.61282530
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00006477
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LuHf5(SnRu2)6
_chemical_formula_sum   'Lu1 Hf5 Sn6 Ru12'
_cell_volume   396.23283086
_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
  Lu  Lu0  1  0.00000000  0.00000000  0.00000000  1.0
  Hf  Hf1  1  0.49994161  0.50000000  0.16686626  1.0
  Hf  Hf2  1  0.99994659  0.00000000  0.33319018  1.0
  Hf  Hf3  1  0.50000100  0.50000000  0.50000000  1.0
  Hf  Hf4  1  0.00005341  0.00000000  0.66680982  1.0
  Hf  Hf5  1  0.50005639  0.50000000  0.83313374  1.0
  Sn  Sn6  1  0.00000000  0.50000000  0.00000000  1.0
  Sn  Sn7  1  0.49995183  0.00000000  0.16587374  1.0
  Sn  Sn8  1  0.99994796  0.50000000  0.33397385  1.0
  Sn  Sn9  1  0.50000100  0.00000000  0.50000000  1.0
  Sn  Sn10  1  0.00005204  0.50000000  0.66602515  1.0
  Sn  Sn11  1  0.50004917  0.00000000  0.83412626  1.0
  Ru  Ru12  1  0.50000100  0.25783943  0.00000000  1.0
  Ru  Ru13  1  0.50000100  0.74216057  0.00000000  1.0
  Ru  Ru14  1  0.99994269  0.25309859  0.17011456  1.0
  Ru  Ru15  1  0.99994269  0.74690041  0.17011456  1.0
  Ru  Ru16  1  0.49994322  0.24950320  0.33420349  1.0
  Ru  Ru17  1  0.49994322  0.75049580  0.33420349  1.0
  Ru  Ru18  1  0.00000000  0.25011763  0.50000000  1.0
  Ru  Ru19  1  0.00000000  0.74988337  0.50000000  1.0
  Ru  Ru20  1  0.50005778  0.24950320  0.66579651  1.0
  Ru  Ru21  1  0.50005778  0.75049580  0.66579651  1.0
  Ru  Ru22  1  0.00005731  0.25309859  0.82988544  1.0
  Ru  Ru23  1  0.00005731  0.74690041  0.82988544  1.0