# generated using pymatgen
data_Hf5Sc(Ti2Sn3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.24980839
_cell_length_b   8.24980885
_cell_length_c   5.56024306
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.98020424
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf5Sc(Ti2Sn3)2
_chemical_formula_sum   'Hf5 Sc1 Ti4 Sn6'
_cell_volume   327.79230374
_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  0.24337737  0.00206871  0.75000000  1.0
  Hf  Hf1  1  0.00206871  0.24337737  0.75000000  1.0
  Hf  Hf2  1  0.23863118  0.23863118  0.25000000  1.0
  Hf  Hf3  1  0.76089227  0.00168080  0.25000000  1.0
  Hf  Hf4  1  0.00168080  0.76089227  0.25000000  1.0
  Sc  Sc5  1  0.75987919  0.75987919  0.75000000  1.0
  Ti  Ti6  1  0.66530137  0.33086922  0.00026001  1.0
  Ti  Ti7  1  0.33086922  0.66530137  0.00026001  1.0
  Ti  Ti8  1  0.33086922  0.66530137  0.49973999  1.0
  Ti  Ti9  1  0.66530137  0.33086922  0.49973999  1.0
  Sn  Sn10  1  0.40116608  0.40116608  0.75000000  1.0
  Sn  Sn11  1  0.60144054  0.99812150  0.75000000  1.0
  Sn  Sn12  1  0.99812150  0.60144054  0.75000000  1.0
  Sn  Sn13  1  0.60097147  0.60097147  0.25000000  1.0
  Sn  Sn14  1  0.39988985  0.99953888  0.25000000  1.0
  Sn  Sn15  1  0.99953888  0.39988985  0.25000000  1.0