# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.29405989
_cell_length_b   22.46951277
_cell_length_c   61.52886828
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P80
_cell_volume   4554.11583862
_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  0.993115  0.870123  0.281700  1
  P  P2  1  0.993115  0.404189  0.236937  1
  P  P3  1  0.993115  0.498328  0.277578  1
  P  P4  1  0.993115  1.031473  0.232522  1
  P  P5  1  0.993115  0.636854  0.259407  1
  P  P6  1  0.993115  1.167912  0.215012  1
  P  P7  1  0.993115  0.732262  0.299876  1
  P  P8  1  0.993115  0.265411  0.254184  1
  P  P9  1  0.493115  0.667912  0.215012  1
  P  P10  1  0.493115  1.136854  0.259407  1
  P  P11  1  0.493115  0.765411  0.254184  1
  P  P12  1  0.493115  1.232262  0.299876  1
  P  P13  1  0.493115  0.904189  0.236937  1
  P  P14  1  0.493115  0.370123  0.281700  1
  P  P15  1  0.493115  0.531473  0.232522  1
  P  P16  1  0.493115  0.998328  0.277578  1
  P  P17  1  0.993115  0.804178  0.372623  1
  P  P18  1  0.993115  0.337218  0.327179  1
  P  P19  1  0.993115  0.432237  0.368420  1
  P  P20  1  0.993115  0.965254  0.323005  1
  P  P21  1  0.993115  0.570679  0.350024  1
  P  P22  1  0.993115  1.103760  0.304682  1
  P  P23  1  0.993115  0.665831  0.391021  1
  P  P24  1  0.993115  1.198983  0.345508  1
  P  P25  1  0.493115  0.603760  0.304682  1
  P  P26  1  0.493115  1.070679  0.350024  1
  P  P27  1  0.493115  0.698983  0.345508  1
  P  P28  1  0.493115  1.165831  0.391021  1
  P  P29  1  0.493115  0.837218  0.327179  1
  P  P30  1  0.493115  0.304178  0.372623  1
  P  P31  1  0.493115  0.465254  0.323005  1
  P  P32  1  0.493115  0.932237  0.368420  1
  P  P33  1  0.993115  0.738086  0.463493  1
  P  P34  1  0.993115  0.271130  0.418061  1
  P  P35  1  0.993115  0.366154  0.459277  1
  P  P36  1  0.993115  0.899198  0.413845  1
  P  P37  1  0.993115  0.504549  0.440854  1
  P  P38  1  0.993115  1.037623  0.395423  1
  P  P39  1  0.993115  0.599661  0.481915  1
  P  P40  1  0.993115  1.132734  0.436484  1
  P  P41  1  0.493115  0.537623  0.395423  1
  P  P42  1  0.493115  1.004549  0.440854  1
  P  P43  1  0.493115  0.632734  0.436484  1
  P  P44  1  0.493115  1.099661  0.481915  1
  P  P45  1  0.493115  0.771130  0.418061  1
  P  P46  1  0.493115  1.238086  0.463493  1
  P  P47  1  0.493115  0.399198  0.413845  1
  P  P48  1  0.493115  0.866154  0.459277  1
  P  P49  1  0.993115  0.672030  0.554333  1
  P  P50  1  0.993115  1.205047  0.508918  1
  P  P51  1  0.993115  0.300066  0.550159  1
  P  P52  1  0.993115  0.833106  0.504715  1
  P  P53  1  0.993115  0.438301  0.531830  1
  P  P54  1  0.993115  0.971453  0.486317  1
  P  P55  1  0.993115  0.533524  0.572656  1
  P  P56  1  0.993115  1.066605  0.527315  1
  P  P57  1  0.493115  0.471453  0.486317  1
  P  P58  1  0.493115  0.938301  0.531830  1
  P  P59  1  0.493115  0.566605  0.527315  1
  P  P60  1  0.493115  1.033524  0.572656  1
  P  P61  1  0.493115  0.705047  0.508918  1
  P  P62  1  0.493115  1.172030  0.554333  1
  P  P63  1  0.493115  0.333106  0.504715  1
  P  P64  1  0.493115  0.800066  0.550159  1
  P  P65  1  0.993115  0.605811  0.644816  1
  P  P66  1  0.993115  1.138956  0.599760  1
  P  P67  1  0.993115  1.233095  0.640401  1
  P  P68  1  0.993115  0.767161  0.595638  1
  P  P69  1  0.993115  0.371873  0.623154  1
  P  P70  1  0.993115  0.905022  0.577462  1
  P  P71  1  0.993115  0.469372  0.662326  1
  P  P72  1  0.993115  1.000430  0.617932  1
  P  P73  1  0.493115  0.405022  0.577462  1
  P  P74  1  0.493115  0.871873  0.623154  1
  P  P75  1  0.493115  0.500430  0.617932  1
  P  P76  1  0.493115  0.969372  0.662326  1
  P  P77  1  0.493115  0.638956  0.599760  1
  P  P78  1  0.493115  1.105811  0.644816  1
  P  P79  1  0.493115  0.267161  0.595638  1
  P  P80  1  0.493115  0.733095  0.640401  1
