# generated using pymatgen
data_Pd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.43502045
_cell_length_b   12.03692414
_cell_length_c   48.80693136
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   102.92096638
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Pd
_chemical_formula_sum   Pd96
_cell_volume   3112.14635169
_cell_formula_units_Z   96
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
  Pd  Pd1  1  0.797672  0.750339  0.284376  1
  Pd  Pd2  1  0.951418  0.058020  0.297420  1
  Pd  Pd3  1  0.112348  0.379760  0.316747  1
  Pd  Pd4  1  0.112348  0.879760  0.316747  1
  Pd  Pd5  1  0.797672  0.250339  0.284376  1
  Pd  Pd6  1  0.951418  0.558020  0.297420  1
  Pd  Pd7  1  0.612348  0.879760  0.316747  1
  Pd  Pd8  1  0.297672  0.250339  0.284376  1
  Pd  Pd9  1  0.451418  0.558020  0.297420  1
  Pd  Pd10  1  0.297672  0.750339  0.284376  1
  Pd  Pd11  1  0.451418  0.058020  0.297420  1
  Pd  Pd12  1  0.612348  0.379760  0.316747  1
  Pd  Pd13  1  0.267237  0.689827  0.334811  1
  Pd  Pd14  1  0.426508  1.008112  0.352932  1
  Pd  Pd15  1  0.583385  0.322191  0.371174  1
  Pd  Pd16  1  0.583385  0.822191  0.371174  1
  Pd  Pd17  1  0.267237  0.189827  0.334811  1
  Pd  Pd18  1  0.426508  0.508112  0.352932  1
  Pd  Pd19  1  0.083385  0.822191  0.371174  1
  Pd  Pd20  1  0.767237  0.189827  0.334811  1
  Pd  Pd21  1  0.926508  0.508112  0.352932  1
  Pd  Pd22  1  0.767237  0.689827  0.334811  1
  Pd  Pd23  1  0.926508  1.008112  0.352932  1
  Pd  Pd24  1  0.083385  0.322191  0.371174  1
  Pd  Pd25  1  0.740964  0.637362  0.390574  1
  Pd  Pd26  1  0.898019  0.951597  0.408849  1
  Pd  Pd27  1  0.055909  0.267396  0.427747  1
  Pd  Pd28  1  0.055909  0.767396  0.427747  1
  Pd  Pd29  1  0.740964  0.137362  0.390574  1
  Pd  Pd30  1  0.898019  0.451597  0.408849  1
  Pd  Pd31  1  0.555909  0.767396  0.427747  1
  Pd  Pd32  1  0.240964  0.137362  0.390574  1
  Pd  Pd33  1  0.398019  0.451597  0.408849  1
  Pd  Pd34  1  0.240964  0.637362  0.390574  1
  Pd  Pd35  1  0.398019  0.951597  0.408849  1
  Pd  Pd36  1  0.555909  0.267396  0.427747  1
  Pd  Pd37  1  0.213116  0.581914  0.446337  1
  Pd  Pd38  1  0.370844  0.897426  0.465078  1
  Pd  Pd39  1  0.528203  0.212272  0.483649  1
  Pd  Pd40  1  0.528203  0.712272  0.483649  1
  Pd  Pd41  1  0.213116  0.081914  0.446337  1
  Pd  Pd42  1  0.370844  0.397426  0.465078  1
  Pd  Pd43  1  0.028203  0.712272  0.483649  1
  Pd  Pd44  1  0.713116  0.081914  0.446337  1
  Pd  Pd45  1  0.870844  0.397426  0.465078  1
  Pd  Pd46  1  0.713116  0.581914  0.446337  1
  Pd  Pd47  1  0.870844  0.897426  0.465078  1
  Pd  Pd48  1  0.028203  0.212272  0.483649  1
  Pd  Pd49  1  0.685842  0.527636  0.502427  1
  Pd  Pd50  1  0.843200  0.842482  0.520998  1
  Pd  Pd51  1  1.000929  0.157994  0.539740  1
  Pd  Pd52  1  1.000929  0.657994  0.539740  1
  Pd  Pd53  1  0.685842  0.027636  0.502427  1
  Pd  Pd54  1  0.843200  0.342482  0.520998  1
  Pd  Pd55  1  0.500929  0.657994  0.539740  1
  Pd  Pd56  1  0.185842  0.027636  0.502427  1
  Pd  Pd57  1  0.343200  0.342482  0.520998  1
  Pd  Pd58  1  0.185842  0.527636  0.502427  1
  Pd  Pd59  1  0.343200  0.842482  0.520998  1
  Pd  Pd60  1  0.500929  0.157994  0.539740  1
  Pd  Pd61  1  0.158135  0.472512  0.558329  1
  Pd  Pd62  1  0.316026  0.788311  0.577228  1
  Pd  Pd63  1  0.473080  0.102546  0.595502  1
  Pd  Pd64  1  0.473080  0.602546  0.595502  1
  Pd  Pd65  1  0.158135  0.972512  0.558329  1
  Pd  Pd66  1  0.316026  0.288311  0.577228  1
  Pd  Pd67  1  0.973080  0.602546  0.595502  1
  Pd  Pd68  1  0.658135  0.972512  0.558329  1
  Pd  Pd69  1  0.816026  0.288311  0.577228  1
  Pd  Pd70  1  0.658135  0.472512  0.558329  1
  Pd  Pd71  1  0.816026  0.788311  0.577228  1
  Pd  Pd72  1  0.973080  0.102546  0.595502  1
  Pd  Pd73  1  0.630659  0.417717  0.614903  1
  Pd  Pd74  1  0.787536  0.731796  0.633145  1
  Pd  Pd75  1  0.946808  0.050081  0.651266  1
  Pd  Pd76  1  0.946808  0.550081  0.651266  1
  Pd  Pd77  1  0.630659  0.917717  0.614903  1
  Pd  Pd78  1  0.787536  0.231796  0.633145  1
  Pd  Pd79  1  0.446808  0.550081  0.651266  1
  Pd  Pd80  1  0.130659  0.917717  0.614903  1
  Pd  Pd81  1  0.287536  0.231796  0.633145  1
  Pd  Pd82  1  0.130659  0.417717  0.614903  1
  Pd  Pd83  1  0.287536  0.731796  0.633145  1
  Pd  Pd84  1  0.446808  0.050081  0.651266  1
  Pd  Pd85  1  0.101697  0.360148  0.669330  1
  Pd  Pd86  1  0.262626  0.681888  0.688657  1
  Pd  Pd87  1  0.416373  0.989569  0.701701  1
  Pd  Pd88  1  0.416373  0.489569  0.701701  1
  Pd  Pd89  1  0.101697  0.860148  0.669330  1
  Pd  Pd90  1  0.262626  0.181888  0.688657  1
  Pd  Pd91  1  0.916373  0.489569  0.701701  1
  Pd  Pd92  1  0.601697  0.860148  0.669330  1
  Pd  Pd93  1  0.762626  0.181888  0.688657  1
  Pd  Pd94  1  0.601697  0.360148  0.669330  1
  Pd  Pd95  1  0.762626  0.681888  0.688657  1
  Pd  Pd96  1  0.916373  0.989569  0.701701  1
