# generated using pymatgen
data_Ce3Sc2Ru3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.49779214
_cell_length_b   7.76263916
_cell_length_c   7.76263821
_cell_angle_alpha   120.00000827
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ce3Sc2Ru3
_chemical_formula_sum   'Ce6 Sc4 Ru6'
_cell_volume   339.09013442
_cell_formula_units_Z   2
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  0.75000000  0.75360731  0.75360731  1.0
  Ce  Ce1  1  0.25000000  0.24639269  0.24639269  1.0
  Ce  Ce2  1  0.75000000  1.00000000  0.24639269  1.0
  Ce  Ce3  1  0.25000000  0.00000000  0.75360731  1.0
  Ce  Ce4  1  0.75000000  0.24639269  1.00000000  1.0
  Ce  Ce5  1  0.25000000  0.75360731  0.00000000  1.0
  Sc  Sc6  1  0.00000000  0.66666700  0.33333300  1.0
  Sc  Sc7  1  0.00000000  0.33333300  0.66666700  1.0
  Sc  Sc8  1  0.50000000  0.33333300  0.66666700  1.0
  Sc  Sc9  1  0.50000000  0.66666700  0.33333300  1.0
  Ru  Ru10  1  0.75000000  0.36846779  0.36846779  1.0
  Ru  Ru11  1  0.25000000  0.63153221  0.63153221  1.0
  Ru  Ru12  1  0.75000000  1.00000000  0.63153221  1.0
  Ru  Ru13  1  0.25000000  0.00000000  0.36846779  1.0
  Ru  Ru14  1  0.75000000  0.63153221  1.00000000  1.0
  Ru  Ru15  1  0.25000000  0.36846779  0.00000000  1.0