# generated using pymatgen
data_Ce3Hf(ScRu2)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.58281521
_cell_length_b   4.64592272
_cell_length_c   9.32747945
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00161500
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ce3Hf(ScRu2)4
_chemical_formula_sum   'Ce3 Hf1 Sc4 Ru8'
_cell_volume   285.26464229
_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
  Ce  Ce0  1  0.75001033  0.25000000  0.12231106  1.0
  Ce  Ce1  1  0.25003240  0.75000000  0.37503198  1.0
  Ce  Ce2  1  0.74996250  0.25000000  0.62771272  1.0
  Hf  Hf3  1  0.24999283  0.75000000  0.87495592  1.0
  Sc  Sc4  1  0.25000800  0.25000000  0.11655782  1.0
  Sc  Sc5  1  0.75002728  0.75000000  0.37496421  1.0
  Sc  Sc6  1  0.24996692  0.25000000  0.63340963  1.0
  Sc  Sc7  1  0.74999523  0.75000000  0.87501525  1.0
  Ru  Ru8  1  0.49748447  0.75000000  0.11999259  1.0
  Ru  Ru9  1  0.00254558  0.75000000  0.11999966  1.0
  Ru  Ru10  1  0.49982511  0.25000000  0.37502830  1.0
  Ru  Ru11  1  0.00020282  0.25000000  0.37502440  1.0
  Ru  Ru12  1  0.00242401  0.75000000  0.62999921  1.0
  Ru  Ru13  1  0.49754776  0.75000000  0.62999733  1.0
  Ru  Ru14  1  0.00513610  0.25000000  0.87500353  1.0
  Ru  Ru15  1  0.49484168  0.25000000  0.87499938  1.0