# generated using pymatgen
data_ScNb(SiPd)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.86283912
_cell_length_b   6.45596437
_cell_length_c   7.54172785
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScNb(SiPd)2
_chemical_formula_sum   'Sc2 Nb2 Si4 Pd4'
_cell_volume   188.07826193
_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
  Sc  Sc0  1  0.75000000  0.96802062  0.67534579  1.0
  Sc  Sc1  1  0.75000000  0.46802062  0.82465421  1.0
  Nb  Nb2  1  0.25000000  0.02932876  0.31609962  1.0
  Nb  Nb3  1  0.25000000  0.52932876  0.18390038  1.0
  Si  Si4  1  0.25000000  0.25792488  0.61110780  1.0
  Si  Si5  1  0.25000000  0.75792488  0.88889220  1.0
  Si  Si6  1  0.75000000  0.73716459  0.36396681  1.0
  Si  Si7  1  0.75000000  0.23716459  0.13603319  1.0
  Pd  Pd8  1  0.25000000  0.14940576  0.93200202  1.0
  Pd  Pd9  1  0.25000000  0.64940576  0.56799798  1.0
  Pd  Pd10  1  0.75000000  0.85815440  0.05674489  1.0
  Pd  Pd11  1  0.75000000  0.35815440  0.44325511  1.0