# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.74627871
_cell_length_b   11.45043645
_cell_length_c   51.74742747
_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   P112
_cell_volume   6960.02992056
_cell_formula_units_Z   112
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  0.865556  0.144738  0.302653  1
  P  P2  1  0.830626  0.670598  0.274191  1
  P  P3  1  1.131785  0.127266  0.317234  1
  P  P4  1  1.097721  0.665110  0.288392  1
  P  P5  1  0.266176  0.906080  0.291436  1
  P  P6  1  0.306597  0.369925  0.319214  1
  P  P7  1  0.536832  0.891550  0.304763  1
  P  P8  1  0.573562  0.351192  0.335075  1
  P  P9  1  0.330626  0.170598  0.274191  1
  P  P10  1  0.365556  0.644738  0.302653  1
  P  P11  1  0.597721  0.165110  0.288392  1
  P  P12  1  0.631785  0.627266  0.317234  1
  P  P13  1  0.806597  0.869925  0.319214  1
  P  P14  1  0.766176  0.406080  0.291436  1
  P  P15  1  1.073562  0.851192  0.335075  1
  P  P16  1  1.036832  0.391550  0.304763  1
  P  P17  1  0.934125  0.064374  0.361663  1
  P  P18  1  0.899023  0.603560  0.332196  1
  P  P19  1  0.201915  0.044279  0.376513  1
  P  P20  1  0.167295  0.584193  0.346592  1
  P  P21  1  0.343489  0.829853  0.349899  1
  P  P22  1  0.379938  0.290578  0.379593  1
  P  P23  1  0.612177  0.811494  0.364508  1
  P  P24  1  0.649008  0.269737  0.394649  1
  P  P25  1  0.399023  0.103560  0.332196  1
  P  P26  1  0.434125  0.564374  0.361663  1
  P  P27  1  0.667295  0.084193  0.346592  1
  P  P28  1  0.701915  0.544279  0.376513  1
  P  P29  1  0.879938  0.790578  0.379593  1
  P  P30  1  0.843489  0.329853  0.349899  1
  P  P31  1  0.149008  0.769737  0.394649  1
  P  P32  1  1.112177  0.311494  0.364508  1
  P  P33  1  1.006950  0.983347  0.421262  1
  P  P34  1  0.970460  0.524214  0.391531  1
  P  P35  1  0.275380  0.963120  0.436160  1
  P  P36  1  0.238582  0.503973  0.406391  1
  P  P37  1  0.418201  0.749669  0.409624  1
  P  P38  1  0.455393  0.208995  0.439488  1
  P  P39  1  0.686709  0.729383  0.424490  1
  P  P40  1  0.724225  0.188597  0.454428  1
  P  P41  1  0.470460  0.024214  0.391531  1
  P  P42  1  0.506950  0.483347  0.421262  1
  P  P43  1  0.738582  1.003973  0.406391  1
  P  P44  1  0.775380  0.463120  0.436160  1
  P  P45  1  0.955393  0.708995  0.439488  1
  P  P46  1  0.918201  0.249669  0.409624  1
  P  P47  1  0.224225  0.688597  0.454428  1
  P  P48  1  0.186709  0.229383  0.424490  1
  P  P49  1  1.081304  0.901956  0.480970  1
  P  P50  1  1.043986  0.442767  0.451129  1
  P  P51  1  0.349967  0.881555  0.495887  1
  P  P52  1  0.312611  0.422350  0.466028  1
  P  P53  1  0.493018  0.668071  0.469356  1
  P  P54  1  0.530374  0.127277  0.499215  1
  P  P55  1  0.761681  0.647671  0.484273  1
  P  P56  1  0.798999  0.106860  0.514114  1
  P  P57  1  0.543986  0.942767  0.451129  1
  P  P58  1  0.581304  0.401956  0.480970  1
  P  P59  1  0.812611  0.922350  0.466028  1
  P  P60  1  0.849967  0.381555  0.495887  1
  P  P61  1  1.030374  0.627277  0.499215  1
  P  P62  1  0.993018  0.168071  0.469356  1
  P  P63  1  0.298999  0.606860  0.514114  1
  P  P64  1  0.261681  0.147671  0.484273  1
  P  P65  1  0.156276  0.820244  0.540753  1
  P  P66  1  1.118760  0.361030  0.510815  1
  P  P67  1  0.424784  0.799957  0.555619  1
  P  P68  1  0.387592  0.340632  0.525755  1
  P  P69  1  0.567605  0.586507  0.529083  1
  P  P70  1  0.604403  0.045653  0.558852  1
  P  P71  1  0.836035  0.566280  0.543982  1
  P  P72  1  0.872524  0.025413  0.573712  1
  P  P73  1  0.618760  0.861030  0.510815  1
  P  P74  1  0.656276  0.320244  0.540753  1
  P  P75  1  0.887592  0.840632  0.525755  1
  P  P76  1  0.924784  0.299957  0.555619  1
  P  P77  1  1.104403  0.545653  0.558852  1
  P  P78  1  1.067605  0.086507  0.529083  1
  P  P79  1  0.372524  0.525413  0.573712  1
  P  P80  1  0.336035  0.066280  0.543982  1
  P  P81  1  0.963046  0.759049  0.585651  1
  P  P82  1  0.999496  0.219774  0.615344  1
  P  P83  1  0.230808  0.738132  0.600735  1
  P  P84  1  0.193977  0.279890  0.570594  1
  P  P85  1  0.641070  0.505348  0.588730  1
  P  P86  1  0.675690  0.965434  0.618651  1
  P  P87  1  0.908860  0.485253  0.603580  1
  P  P88  1  0.943961  0.946067  0.633047  1
  P  P89  1  0.499496  0.719774  0.615344  1
  P  P90  1  0.463046  0.259049  0.585651  1
  P  P91  1  0.693977  0.779890  0.570594  1
  P  P92  1  0.730808  0.238132  0.600735  1
  P  P93  1  0.175690  0.465434  0.618651  1
  P  P94  1  0.141070  1.005348  0.588730  1
  P  P95  1  0.443961  0.446067  0.633047  1
  P  P96  1  0.408860  0.985253  0.603580  1
  P  P97  1  1.036387  0.679702  0.646029  1
  P  P98  1  1.076808  0.143547  0.673807  1
  P  P99  1  0.306152  0.658077  0.660480  1
  P  P100  1  0.269422  0.198435  0.630168  1
  P  P101  1  0.711199  0.422361  0.648009  1
  P  P102  1  0.745264  0.884516  0.676851  1
  P  P103  1  0.977429  0.404888  0.662590  1
  P  P104  1  1.012358  0.879029  0.691052  1
  P  P105  1  0.576808  0.643547  0.673807  1
  P  P106  1  0.536387  0.179702  0.646029  1
  P  P107  1  0.769422  0.698435  0.630168  1
  P  P108  1  0.806152  0.158077  0.660480  1
  P  P109  1  0.245264  0.384516  0.676851  1
  P  P110  1  0.211199  0.922361  0.648009  1
  P  P111  1  0.512358  0.379029  0.691052  1
  P  P112  1  0.477429  0.904888  0.662590  1
