# generated using pymatgen
data_Sc4TiSn3Ru8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.32131515
_cell_length_b   6.41564545
_cell_length_c   6.32176177
_cell_angle_alpha   90.01421615
_cell_angle_beta   89.99672006
_cell_angle_gamma   89.98721448
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc4TiSn3Ru8
_chemical_formula_sum   'Sc4 Ti1 Sn3 Ru8'
_cell_volume   256.38103682
_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
  Sc  Sc0  1  0.99999796  0.25000406  0.99997954  1.0
  Sc  Sc1  1  0.00000052  0.75000180  0.99999211  1.0
  Sc  Sc2  1  0.49998736  0.75000231  0.50001173  1.0
  Sc  Sc3  1  0.50001914  0.25000490  0.50001816  1.0
  Ti  Ti4  1  0.50000406  0.24999707  0.00002305  1.0
  Sn  Sn5  1  0.49998545  0.74999503  0.00000689  1.0
  Sn  Sn6  1  0.99999223  0.24999666  0.49999520  1.0
  Sn  Sn7  1  0.00000411  0.75000074  0.49999376  1.0
  Ru  Ru8  1  0.25262711  0.49400230  0.24736298  1.0
  Ru  Ru9  1  0.25262046  0.00604068  0.24739279  1.0
  Ru  Ru10  1  0.74744274  0.49400217  0.24741078  1.0
  Ru  Ru11  1  0.74739237  0.00602033  0.24741492  1.0
  Ru  Ru12  1  0.25260714  0.49397040  0.75257330  1.0
  Ru  Ru13  1  0.25256169  0.00601125  0.75258441  1.0
  Ru  Ru14  1  0.74738427  0.49398918  0.75260402  1.0
  Ru  Ru15  1  0.74737340  0.00596810  0.75263836  1.0