# generated using pymatgen
data_Lu3Sc(SnRu2)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.38957672
_cell_length_b   6.59825765
_cell_length_c   6.38957412
_cell_angle_alpha   89.99962454
_cell_angle_beta   90.00028256
_cell_angle_gamma   89.99994202
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Lu3Sc(SnRu2)4
_chemical_formula_sum   'Lu3 Sc1 Sn4 Ru8'
_cell_volume   269.38491465
_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  0.99999255  0.24999572  0.00000638  1.0
  Lu  Lu1  1  0.00001180  0.74997082  0.99999573  1.0
  Lu  Lu2  1  0.49998564  0.75002244  0.49999267  1.0
  Sc  Sc3  1  0.50000545  0.25003988  0.50001297  1.0
  Sn  Sn4  1  0.49999974  0.25002715  0.00000519  1.0
  Sn  Sn5  1  0.49999721  0.74996520  0.99998637  1.0
  Sn  Sn6  1  0.00000157  0.25002376  0.50000286  1.0
  Sn  Sn7  1  0.00000543  0.74996770  0.50000563  1.0
  Ru  Ru8  1  0.25239263  0.49749966  0.25237704  1.0
  Ru  Ru9  1  0.25238700  0.00249383  0.25236987  1.0
  Ru  Ru10  1  0.74761811  0.49752114  0.25239584  1.0
  Ru  Ru11  1  0.74762540  0.00249275  0.25239097  1.0
  Ru  Ru12  1  0.25238071  0.49749022  0.74760292  1.0
  Ru  Ru13  1  0.25237188  0.00249253  0.74761227  1.0
  Ru  Ru14  1  0.74761048  0.49751258  0.74761598  1.0
  Ru  Ru15  1  0.74761340  0.00248962  0.74762631  1.0