# generated using pymatgen
data_Pb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.67958083
_cell_length_b   10.68041002
_cell_length_c   49.56863912
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   78.46304097
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Pb
_chemical_formula_sum   Pb80
_cell_volume   5539.68084547
_cell_formula_units_Z   80
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
  Pb  Pb1  1  0.196054  0.198721  0.278030  1
  Pb  Pb2  1  0.525090  0.527748  0.353131  1
  Pb  Pb3  1  0.606039  0.114460  0.314543  1
  Pb  Pb4  1  0.111789  0.608702  0.314544  1
  Pb  Pb5  1  0.861898  0.864567  0.315078  1
  Pb  Pb6  1  0.359880  0.362548  0.315118  1
  Pb  Pb7  1  0.274583  0.776744  0.352987  1
  Pb  Pb8  1  0.774084  0.277240  0.352988  1
  Pb  Pb9  1  0.150400  0.903372  0.296652  1
  Pb  Pb10  1  0.647778  0.401551  0.296793  1
  Pb  Pb11  1  0.567490  0.817256  0.331623  1
  Pb  Pb12  1  0.062356  0.322703  0.332595  1
  Pb  Pb13  1  0.900711  0.153060  0.296653  1
  Pb  Pb14  1  0.398892  0.650432  0.296793  1
  Pb  Pb15  1  0.320044  0.065013  0.332594  1
  Pb  Pb16  1  0.814596  0.570151  0.331625  1
  Pb  Pb17  1  0.026034  0.028691  0.352841  1
  Pb  Pb18  1  0.359094  0.361794  0.437894  1
  Pb  Pb19  1  0.447196  0.947972  0.393287  1
  Pb  Pb20  1  0.945276  0.449897  0.393286  1
  Pb  Pb21  1  0.695532  0.698229  0.392032  1
  Pb  Pb22  1  0.196135  0.198834  0.394263  1
  Pb  Pb23  1  0.108843  0.610926  0.437672  1
  Pb  Pb24  1  0.608223  0.111542  0.437671  1
  Pb  Pb25  1  0.983364  0.736995  0.371540  1
  Pb  Pb26  1  0.485282  0.236116  0.372451  1
  Pb  Pb27  1  0.404520  0.656793  0.414974  1
  Pb  Pb28  1  0.903703  0.157168  0.417647  1
  Pb  Pb29  1  0.734317  0.986037  0.371539  1
  Pb  Pb30  1  0.233445  0.487960  0.372452  1
  Pb  Pb31  1  0.154467  0.906404  0.417647  1
  Pb  Pb32  1  0.654089  0.407225  0.414975  1
  Pb  Pb33  1  0.857469  0.860170  0.438140  1
  Pb  Pb34  1  0.187296  0.190066  0.522645  1
  Pb  Pb35  1  0.271906  0.774230  0.479923  1
  Pb  Pb36  1  0.771495  0.274641  0.479923  1
  Pb  Pb37  1  0.521392  0.524127  0.479661  1
  Pb  Pb38  1  0.022292  0.025028  0.480265  1
  Pb  Pb39  1  0.935598  0.438799  0.521985  1
  Pb  Pb40  1  0.436030  0.938368  0.521986  1
  Pb  Pb41  1  0.813765  0.566482  0.458375  1
  Pb  Pb42  1  0.316129  0.068643  0.459587  1
  Pb  Pb43  1  0.229789  0.482400  0.501412  1
  Pb  Pb44  1  0.727774  0.980551  0.500293  1
  Pb  Pb45  1  0.563764  0.816480  0.458375  1
  Pb  Pb46  1  0.065927  0.318846  0.459587  1
  Pb  Pb47  1  0.977798  0.730527  0.500294  1
  Pb  Pb48  1  0.479647  0.232542  0.501412  1
  Pb  Pb49  1  0.683437  0.686208  0.521697  1
  Pb  Pb50  1  0.019453  0.022262  0.608226  1
  Pb  Pb51  1  0.097287  0.598135  0.565533  1
  Pb  Pb52  1  0.595362  0.100064  0.565531  1
  Pb  Pb53  1  0.347066  0.349841  0.567140  1
  Pb  Pb54  1  0.845091  0.847867  0.563563  1
  Pb  Pb55  1  0.768193  0.270638  0.608025  1
  Pb  Pb56  1  0.267830  0.771006  0.608025  1
  Pb  Pb57  1  0.640378  0.393768  0.543947  1
  Pb  Pb58  1  0.141596  0.893939  0.542036  1
  Pb  Pb59  1  0.058593  0.310348  0.588888  1
  Pb  Pb60  1  0.555907  0.809450  0.587622  1
  Pb  Pb61  1  0.390989  0.643156  0.543947  1
  Pb  Pb62  1  0.891157  0.144376  0.542036  1
  Pb  Pb63  1  0.806656  0.558695  0.587621  1
  Pb  Pb64  1  0.307561  0.061387  0.588889  1
  Pb  Pb65  1  0.518766  0.521576  0.607941  1
  Pb  Pb66  1  0.852946  0.855762  0.682491  1
  Pb  Pb67  1  0.930880  0.439894  0.647105  1
  Pb  Pb68  1  0.437082  0.933688  0.647106  1
  Pb  Pb69  1  0.186219  0.189033  0.647670  1
  Pb  Pb70  1  0.685298  0.688108  0.648090  1
  Pb  Pb71  1  0.604051  0.099683  0.683008  1
  Pb  Pb72  1  0.096867  0.606869  0.683007  1
  Pb  Pb73  1  0.474928  0.231917  0.628364  1
  Pb  Pb74  1  0.977037  0.728871  0.626465  1
  Pb  Pb75  1  0.891315  0.144506  0.664379  1
  Pb  Pb76  1  0.391325  0.645613  0.664511  1
  Pb  Pb77  1  0.229099  0.477744  0.628363  1
  Pb  Pb78  1  0.726051  0.979859  0.626466  1
  Pb  Pb79  1  0.642800  0.394137  0.664512  1
  Pb  Pb80  1  0.141696  0.894124  0.664379  1
