# generated using pymatgen
data_Nd2Si4As2Pd21
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.71795896
_cell_length_b   8.67224359
_cell_length_c   8.67224380
_cell_angle_alpha   60.48002151
_cell_angle_beta   59.82547539
_cell_angle_gamma   59.82546716
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd2Si4As2Pd21
_chemical_formula_sum   'Nd2 Si4 As2 Pd21'
_cell_volume   464.03889169
_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
  Nd  Nd0  1  0.75012185  0.75018835  0.74956795  1.0
  Nd  Nd1  1  0.24987815  0.25043205  0.24981165  1.0
  Si  Si2  1  0.73762232  0.26215865  0.26259772  1.0
  Si  Si3  1  0.26273001  0.26281608  0.73718392  1.0
  Si  Si4  1  0.73726999  0.26281608  0.73718392  1.0
  Si  Si5  1  0.26237768  0.73740228  0.73784135  1.0
  As  As6  1  0.73844131  0.73898259  0.26101741  1.0
  As  As7  1  0.26155869  0.73898259  0.26101741  1.0
  Pd  Pd8  1  1.00000000  0.00147377  0.99852623  1.0
  Pd  Pd9  1  0.61791838  0.60788020  0.15628305  1.0
  Pd  Pd10  1  0.61435770  0.15623285  0.61505275  1.0
  Pd  Pd11  1  0.15677507  0.61067826  0.62030948  1.0
  Pd  Pd12  1  0.61223719  0.61067826  0.62030948  1.0
  Pd  Pd13  1  0.38564230  0.38494725  0.84376715  1.0
  Pd  Pd14  1  0.38208162  0.84371695  0.39211980  1.0
  Pd  Pd15  1  0.84322493  0.37969052  0.38932174  1.0
  Pd  Pd16  1  0.38776281  0.37969052  0.38932174  1.0
  Pd  Pd17  1  0.99511660  0.00793517  0.34633601  1.0
  Pd  Pd18  1  0.65061322  0.00793517  0.34633601  1.0
  Pd  Pd19  1  0.00000000  0.64991291  0.35008709  1.0
  Pd  Pd20  1  0.65666677  0.34589844  0.99967414  1.0
  Pd  Pd21  1  0.99776165  0.34589844  0.99967414  1.0
  Pd  Pd22  1  1.00000000  0.34348805  0.65651195  1.0
  Pd  Pd23  1  0.34938678  0.65366399  0.99206483  1.0
  Pd  Pd24  1  0.34333323  0.00032586  0.65410156  1.0
  Pd  Pd25  1  0.34635800  0.00609293  0.99390707  1.0
  Pd  Pd26  1  0.00223835  0.00032586  0.65410156  1.0
  Pd  Pd27  1  0.00488340  0.65366399  0.99206483  1.0
  Pd  Pd28  1  0.65364200  0.00609293  0.99390707  1.0