# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.61925217
_cell_length_b   11.99342135
_cell_length_c   51.00990509
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   103.38944655
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P80
_cell_volume   5129.7834942
_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
  P  P1  1  0.231567  1.033180  0.338858  1
  P  P2  1  0.533660  1.089228  0.298874  1
  P  P3  1  1.022308  0.835954  0.299856  1
  P  P4  1  0.727575  0.782262  0.339856  1
  P  P5  1  0.231567  0.533180  0.338858  1
  P  P6  1  0.533660  0.589228  0.298874  1
  P  P7  1  1.022308  0.335954  0.299856  1
  P  P8  1  0.727575  0.282262  0.339856  1
  P  P9  1  0.883887  0.562467  0.318494  1
  P  P10  1  0.581867  0.504507  0.358930  1
  P  P11  1  0.674172  0.364643  0.280753  1
  P  P12  1  0.374110  0.308576  0.318961  1
  P  P13  1  0.883887  1.062467  0.318494  1
  P  P14  1  0.581867  1.004507  0.358930  1
  P  P15  1  0.674172  0.864643  0.280753  1
  P  P16  1  0.374110  0.808576  0.318961  1
  P  P17  1  0.634451  0.922191  0.420372  1
  P  P18  1  0.933307  0.978508  0.379633  1
  P  P19  1  0.430045  0.726611  0.380018  1
  P  P20  1  0.133199  0.672076  0.420897  1
  P  P21  1  0.634451  0.422191  0.420372  1
  P  P22  1  0.933307  0.478508  0.379633  1
  P  P23  1  0.430045  0.226611  0.380018  1
  P  P24  1  0.133199  0.172076  0.420897  1
  P  P25  1  0.284242  0.450584  0.400109  1
  P  P26  1  0.985377  0.394781  0.440808  1
  P  P27  1  0.079868  0.255573  0.360033  1
  P  P28  1  0.781359  0.198945  0.400521  1
  P  P29  1  0.284242  0.950584  0.400109  1
  P  P30  1  0.985377  0.894781  0.440808  1
  P  P31  1  0.079868  0.755573  0.360033  1
  P  P32  1  0.781359  0.698945  0.400521  1
  P  P33  1  1.038490  0.812165  0.501992  1
  P  P34  1  0.336497  0.867338  0.461253  1
  P  P35  1  0.835119  0.616602  0.461560  1
  P  P36  1  0.537112  0.561429  0.502298  1
  P  P37  1  1.038490  0.312165  0.501992  1
  P  P38  1  0.336497  0.367338  0.461253  1
  P  P39  1  0.835119  1.116602  0.461560  1
  P  P40  1  0.537112  1.061429  0.502298  1
  P  P41  1  0.687521  0.339711  0.481611  1
  P  P42  1  0.389434  0.284316  0.522331  1
  P  P43  1  0.484175  1.144451  0.441221  1
  P  P44  1  0.186088  1.089056  0.481941  1
  P  P45  1  0.687521  0.839711  0.481611  1
  P  P46  1  0.389434  0.784316  0.522331  1
  P  P47  1  0.484175  0.644451  0.441221  1
  P  P48  1  0.186088  0.589056  0.481941  1
  P  P49  1  0.443564  0.702155  0.583534  1
  P  P50  1  0.740410  0.756691  0.542654  1
  P  P51  1  0.239158  0.506575  0.543180  1
  P  P52  1  0.940302  0.450259  0.583919  1
  P  P53  1  0.443564  0.202155  0.583534  1
  P  P54  1  0.740410  0.256691  0.542654  1
  P  P55  1  0.239158  1.006575  0.543180  1
  P  P56  1  0.940302  0.950259  0.583919  1
  P  P57  1  0.092250  0.229821  0.563030  1
  P  P58  1  0.793741  0.173193  0.603519  1
  P  P59  1  0.888232  1.033986  0.522743  1
  P  P60  1  0.589367  0.978183  0.563443  1
  P  P61  1  0.092250  0.729821  0.563030  1
  P  P62  1  0.793741  0.673193  0.603519  1
  P  P63  1  0.888232  0.533986  0.522743  1
  P  P64  1  0.589367  0.478183  0.563443  1
  P  P65  1  0.851301  0.592813  0.663696  1
  P  P66  1  0.146034  0.646504  0.623696  1
  P  P67  1  0.642042  0.395586  0.624694  1
  P  P68  1  0.339949  0.339538  0.664678  1
  P  P69  1  0.851301  1.092813  0.663696  1
  P  P70  1  0.146034  1.146504  0.623696  1
  P  P71  1  0.642042  0.895586  0.624694  1
  P  P72  1  0.339949  0.839538  0.664678  1
  P  P73  1  0.499499  1.120191  0.644591  1
  P  P74  1  0.199437  1.064124  0.682799  1
  P  P75  1  0.291742  0.924260  0.604622  1
  P  P76  1  0.989722  0.866299  0.645058  1
  P  P77  1  0.499499  0.620191  0.644591  1
  P  P78  1  0.199437  0.564124  0.682799  1
  P  P79  1  0.291742  0.424260  0.604622  1
  P  P80  1  0.989722  0.366299  0.645058  1
