# generated using pymatgen
data_Si4Ni16(AsPd2)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.86029954
_cell_length_b   7.86029936
_cell_length_c   7.90630038
_cell_angle_alpha   59.80622534
_cell_angle_beta   59.80622610
_cell_angle_gamma   60.38755587
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Si4Ni16(AsPd2)3
_chemical_formula_sum   'Si4 Ni16 As3 Pd6'
_cell_volume   345.38748402
_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
  Si  Si0  1  0.00000000  0.50000000  0.00000000  1.0
  Si  Si1  1  0.50000000  0.00000000  0.00000000  1.0
  Si  Si2  1  0.00000000  0.50000000  0.50000000  1.0
  Si  Si3  1  0.50000000  0.00000000  0.50000000  1.0
  Ni  Ni4  1  0.33018841  0.33018841  0.33280555  1.0
  Ni  Ni5  1  0.99318337  0.66719445  0.66981159  1.0
  Ni  Ni6  1  0.66719445  0.99318337  0.66981159  1.0
  Ni  Ni7  1  0.66981159  0.66981159  0.99318337  1.0
  Ni  Ni8  1  0.33280555  0.00681663  0.33018841  1.0
  Ni  Ni9  1  0.33018841  0.33018841  0.00681663  1.0
  Ni  Ni10  1  0.00681663  0.33280555  0.33018841  1.0
  Ni  Ni11  1  0.66981159  0.66981159  0.66719445  1.0
  Ni  Ni12  1  0.12033287  0.12033287  0.11323622  1.0
  Ni  Ni13  1  0.35390197  0.88676378  0.87966713  1.0
  Ni  Ni14  1  0.88676378  0.35390197  0.87966713  1.0
  Ni  Ni15  1  0.87966713  0.87966713  0.35390197  1.0
  Ni  Ni16  1  0.11323622  0.64609803  0.12033287  1.0
  Ni  Ni17  1  0.12033287  0.12033287  0.64609803  1.0
  Ni  Ni18  1  0.64609803  0.11323622  0.12033287  1.0
  Ni  Ni19  1  0.87966713  0.87966713  0.88676378  1.0
  As  As20  1  0.00000000  0.00000000  0.00000000  1.0
  As  As21  1  0.00000000  0.00000000  0.50000000  1.0
  As  As22  1  0.50000000  0.50000000  0.00000000  1.0
  Pd  Pd23  1  0.30735343  0.69264657  0.30735343  1.0
  Pd  Pd24  1  0.30735343  0.69264657  0.69264657  1.0
  Pd  Pd25  1  0.69264657  0.30735343  0.30735343  1.0
  Pd  Pd26  1  0.69268441  0.69268441  0.30731559  1.0
  Pd  Pd27  1  0.30731559  0.30731559  0.69268441  1.0
  Pd  Pd28  1  0.69264657  0.30735343  0.69264657  1.0