# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   25.50781142
_cell_length_b   24.74816024
_cell_length_c   55.78073315
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   108.84856673
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P576
_cell_volume   33324.5227996
_cell_formula_units_Z   576
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  0.854268  0.564206  0.279371  1
  P  P2  1  0.624400  0.596768  0.242549  1
  P  P3  1  0.520935  0.564206  0.279371  1
  P  P4  1  0.291066  0.596768  0.242549  1
  P  P5  1  0.354268  1.064206  0.279371  1
  P  P6  1  0.187602  0.564206  0.279371  1
  P  P7  1  0.124400  1.096768  0.242549  1
  P  P8  1  0.957733  0.596768  0.242549  1
  P  P9  1  1.020935  1.064206  0.279371  1
  P  P10  1  0.791066  1.096768  0.242549  1
  P  P11  1  0.687602  1.064206  0.279371  1
  P  P12  1  0.457733  1.096768  0.242549  1
  P  P13  1  0.955058  0.926132  0.295323  1
  P  P14  1  0.725721  0.957403  0.257861  1
  P  P15  1  0.621725  0.926132  0.295323  1
  P  P16  1  0.392388  0.957403  0.257861  1
  P  P17  1  0.455058  0.426132  0.295323  1
  P  P18  1  0.288392  0.926132  0.295323  1
  P  P19  1  0.225721  0.457403  0.257861  1
  P  P20  1  1.059055  0.957403  0.257861  1
  P  P21  1  0.121725  0.426132  0.295323  1
  P  P22  1  0.892388  0.457403  0.257861  1
  P  P23  1  0.788392  0.426132  0.295323  1
  P  P24  1  0.559055  0.457403  0.257861  1
  P  P25  1  0.942213  0.791239  0.306425  1
  P  P26  1  0.714034  0.822531  0.269287  1
  P  P27  1  0.608880  0.791239  0.306425  1
  P  P28  1  0.380701  0.822531  0.269287  1
  P  P29  1  0.442213  0.291239  0.306425  1
  P  P30  1  0.275546  0.791239  0.306425  1
  P  P31  1  0.214034  0.322531  0.269287  1
  P  P32  1  1.047367  0.822531  0.269287  1
  P  P33  1  0.108880  0.291239  0.306425  1
  P  P34  1  0.880701  0.322531  0.269287  1
  P  P35  1  0.775546  0.291239  0.306425  1
  P  P36  1  0.547367  0.322531  0.269287  1
  P  P37  1  0.863297  0.696684  0.267049  1
  P  P38  1  0.634514  0.730614  0.231989  1
  P  P39  1  0.529964  0.696684  0.267049  1
  P  P40  1  0.301181  0.730614  0.231989  1
  P  P41  1  0.363297  0.196684  0.267049  1
  P  P42  1  0.196631  0.696684  0.267049  1
  P  P43  1  0.134514  0.230614  0.231989  1
  P  P44  1  0.967848  0.730614  0.231989  1
  P  P45  1  1.029964  0.196684  0.267049  1
  P  P46  1  0.801181  0.230614  0.231989  1
  P  P47  1  0.696631  0.196684  0.267049  1
  P  P48  1  0.467848  0.230614  0.231989  1
  P  P49  1  0.827042  0.804653  0.288038  1
  P  P50  1  0.598673  0.838502  0.251240  1
  P  P51  1  0.493708  0.804653  0.288038  1
  P  P52  1  0.265340  0.838502  0.251240  1
  P  P53  1  0.327042  0.304653  0.288038  1
  P  P54  1  0.160375  0.804653  0.288038  1
  P  P55  1  0.098673  0.338502  0.251240  1
  P  P56  1  0.932006  0.838502  0.251240  1
  P  P57  1  0.993708  0.304653  0.288038  1
  P  P58  1  0.765340  0.338502  0.251240  1
  P  P59  1  0.660375  0.304653  0.288038  1
  P  P60  1  0.432006  0.338502  0.251240  1
  P  P61  1  0.746605  0.709963  0.249408  1
  P  P62  1  0.645523  0.683609  0.286724  1
  P  P63  1  0.413272  0.709963  0.249408  1
  P  P64  1  0.312190  0.683609  0.286724  1
  P  P65  1  0.246605  0.209963  0.249408  1
  P  P66  1  0.079938  0.709963  0.249408  1
  P  P67  1  0.145523  1.183609  0.286724  1
  P  P68  1  0.978857  0.683609  0.286724  1
  P  P69  1  0.913272  0.209963  0.249408  1
  P  P70  1  0.812190  1.183609  0.286724  1
  P  P71  1  0.579938  0.209963  0.249408  1
  P  P72  1  0.478857  1.183609  0.286724  1
  P  P73  1  0.738747  0.577651  0.260231  1
  P  P74  1  0.635652  0.548388  0.297575  1
  P  P75  1  0.405414  0.577651  0.260231  1
  P  P76  1  0.302319  0.548388  0.297575  1
  P  P77  1  0.238747  1.077651  0.260231  1
  P  P78  1  0.072081  0.577651  0.260231  1
  P  P79  1  0.135652  1.048388  0.297575  1
  P  P80  1  0.968985  0.548388  0.297575  1
  P  P81  1  0.905414  1.077651  0.260231  1
  P  P82  1  0.802319  1.048388  0.297575  1
  P  P83  1  0.572081  1.077651  0.260231  1
  P  P84  1  0.468985  1.048388  0.297575  1
  P  P85  1  0.839515  0.938784  0.275917  1
  P  P86  1  0.612013  0.973154  0.240494  1
  P  P87  1  0.506182  0.938784  0.275917  1
  P  P88  1  0.278679  0.973154  0.240494  1
  P  P89  1  0.339515  0.438784  0.275917  1
  P  P90  1  0.172849  0.938784  0.275917  1
  P  P91  1  0.112013  0.473154  0.240494  1
  P  P92  1  0.945346  0.973154  0.240494  1
  P  P93  1  1.006182  0.438784  0.275917  1
  P  P94  1  0.778679  0.473154  0.240494  1
  P  P95  1  0.672849  0.438784  0.275917  1
  P  P96  1  0.445346  0.473154  0.240494  1
  P  P97  1  0.979672  0.502992  0.354071  1
  P  P98  1  0.749568  0.532379  0.316195  1
  P  P99  1  0.646339  0.502992  0.354071  1
  P  P100  1  0.416235  0.532379  0.316195  1
  P  P101  1  0.479672  1.002992  0.354071  1
  P  P102  1  0.313005  0.502992  0.354071  1
  P  P103  1  0.249568  1.032379  0.316195  1
  P  P104  1  0.082901  0.532379  0.316195  1
  P  P105  1  0.146339  1.002992  0.354071  1
  P  P106  1  0.916235  1.032379  0.316195  1
  P  P107  1  0.813005  1.002992  0.354071  1
  P  P108  1  0.582901  1.032379  0.316195  1
  P  P109  1  0.080361  0.865237  0.370461  1
  P  P110  1  0.850561  0.894873  0.332600  1
  P  P111  1  0.747027  0.865237  0.370461  1
  P  P112  1  0.517227  0.894873  0.332600  1
  P  P113  1  0.580361  0.365237  0.370461  1
  P  P114  1  0.413694  0.865237  0.370461  1
  P  P115  1  0.350561  0.394873  0.332600  1
  P  P116  1  0.183894  0.894873  0.332600  1
  P  P117  1  0.247027  0.365237  0.370461  1
  P  P118  1  1.017227  0.394873  0.332600  1
  P  P119  1  0.913694  0.365237  0.370461  1
  P  P120  1  0.683894  0.394873  0.332600  1
  P  P121  1  0.068113  0.730523  0.382077  1
  P  P122  1  0.838401  0.760646  0.344444  1
  P  P123  1  0.734779  0.730523  0.382077  1
  P  P124  1  0.505068  0.760646  0.344444  1
  P  P125  1  0.568113  0.230523  0.382077  1
  P  P126  1  0.401446  0.730523  0.382077  1
  P  P127  1  0.338401  0.260646  0.344444  1
  P  P128  1  0.171734  0.760646  0.344444  1
  P  P129  1  0.234779  0.230523  0.382077  1
  P  P130  1  1.005068  0.260646  0.344444  1
  P  P131  1  0.901446  0.230523  0.382077  1
  P  P132  1  0.671734  0.260646  0.344444  1
  P  P133  1  0.990428  0.637464  0.342605  1
  P  P134  1  0.760463  0.666931  0.304853  1
  P  P135  1  0.657095  0.637464  0.342605  1
  P  P136  1  0.427129  0.666931  0.304853  1
  P  P137  1  0.490428  1.137464  0.342605  1
  P  P138  1  0.323762  0.637464  0.342605  1
  P  P139  1  0.260463  1.166931  0.304853  1
  P  P140  1  0.093796  0.666931  0.304853  1
  P  P141  1  0.157095  1.137464  0.342605  1
  P  P142  1  0.927129  1.166931  0.304853  1
  P  P143  1  0.823762  1.137464  0.342605  1
  P  P144  1  0.593796  1.166931  0.304853  1
  P  P145  1  0.953395  0.745837  0.363188  1
  P  P146  1  0.723825  0.776266  0.325630  1
  P  P147  1  0.620061  0.745837  0.363188  1
  P  P148  1  0.390491  0.776266  0.325630  1
  P  P149  1  0.453395  0.245837  0.363188  1
  P  P150  1  0.286728  0.745837  0.363188  1
  P  P151  1  0.223825  0.276266  0.325630  1
  P  P152  1  1.057158  0.776266  0.325630  1
  P  P153  1  0.120061  0.245837  0.363188  1
  P  P154  1  0.890491  0.276266  0.325630  1
  P  P155  1  0.786728  0.245837  0.363188  1
  P  P156  1  0.557158  0.276266  0.325630  1
  P  P157  1  0.875390  0.653034  0.323870  1
  P  P158  1  0.771841  0.621965  0.361251  1
  P  P159  1  0.542057  0.653034  0.323870  1
  P  P160  1  0.438508  0.621965  0.361251  1
  P  P161  1  0.375390  1.153034  0.323870  1
  P  P162  1  0.208724  0.653034  0.323870  1
  P  P163  1  0.271841  1.121965  0.361251  1
  P  P164  1  0.105175  0.621965  0.361251  1
  P  P165  1  1.042057  1.153034  0.323870  1
  P  P166  1  0.938508  1.121965  0.361251  1
  P  P167  1  0.708724  1.153034  0.323870  1
  P  P168  1  0.605175  1.121965  0.361251  1
  P  P169  1  0.865058  0.518503  0.335334  1
  P  P170  1  0.760911  0.487599  0.372746  1
  P  P171  1  0.531724  0.518503  0.335334  1
  P  P172  1  0.427578  0.487599  0.372746  1
  P  P173  1  0.365058  1.018503  0.335334  1
  P  P174  1  0.198391  0.518503  0.335334  1
  P  P175  1  0.260911  0.987599  0.372746  1
  P  P176  1  0.094244  0.487599  0.372746  1
  P  P177  1  1.031724  1.018503  0.335334  1
  P  P178  1  0.927578  0.987599  0.372746  1
  P  P179  1  0.698391  1.018503  0.335334  1
  P  P180  1  0.594244  0.987599  0.372746  1
  P  P181  1  0.965625  0.880171  0.351549  1
  P  P182  1  0.736455  0.910990  0.313852  1
  P  P183  1  0.632292  0.880171  0.351549  1
  P  P184  1  0.403121  0.910990  0.313852  1
  P  P185  1  0.465625  0.380171  0.351549  1
  P  P186  1  0.298959  0.880171  0.351549  1
  P  P187  1  0.236455  0.410990  0.313852  1
  P  P188  1  0.069788  0.910990  0.313852  1
  P  P189  1  0.132292  0.380171  0.351549  1
  P  P190  1  0.903121  0.410990  0.313852  1
  P  P191  1  0.798959  0.380171  0.351549  1
  P  P192  1  0.569788  0.410990  0.313852  1
  P  P193  1  0.105238  0.442532  0.429263  1
  P  P194  1  0.875750  0.472848  0.391651  1
  P  P195  1  0.771904  0.442532  0.429263  1
  P  P196  1  0.542417  0.472848  0.391651  1
  P  P197  1  0.605238  0.942532  0.429263  1
  P  P198  1  0.438571  0.442532  0.429263  1
  P  P199  1  0.375750  0.972848  0.391651  1
  P  P200  1  0.209084  0.472848  0.391651  1
  P  P201  1  0.271904  0.942532  0.429263  1
  P  P202  1  1.042417  0.972848  0.391651  1
  P  P203  1  0.938571  0.942532  0.429263  1
  P  P204  1  0.709084  0.972848  0.391651  1
  P  P205  1  0.205897  0.804597  0.445708  1
  P  P206  1  0.976428  0.834891  0.408072  1
  P  P207  1  0.872563  0.804597  0.445708  1
  P  P208  1  0.643095  0.834891  0.408072  1
  P  P209  1  0.705897  0.304597  0.445708  1
  P  P210  1  0.539230  0.804597  0.445708  1
  P  P211  1  0.476428  0.334891  0.408072  1
  P  P212  1  0.309761  0.834891  0.408072  1
  P  P213  1  0.372563  0.304597  0.445708  1
  P  P214  1  0.143095  0.334891  0.408072  1
  P  P215  1  1.039230  0.304597  0.445708  1
  P  P216  1  0.809761  0.334891  0.408072  1
  P  P217  1  0.194156  0.670045  0.457291  1
  P  P218  1  0.964499  0.700403  0.419699  1
  P  P219  1  0.860823  0.670045  0.457291  1
  P  P220  1  0.631166  0.700403  0.419699  1
  P  P221  1  0.694156  1.170045  0.457291  1
  P  P222  1  0.527490  0.670045  0.457291  1
  P  P223  1  0.464499  0.200403  0.419699  1
  P  P224  1  0.297832  0.700403  0.419699  1
  P  P225  1  0.360823  1.170045  0.457291  1
  P  P226  1  0.131166  0.200403  0.419699  1
  P  P227  1  1.027490  1.170045  0.457291  1
  P  P228  1  0.797832  0.200403  0.419699  1
  P  P229  1  0.116651  0.576962  0.417660  1
  P  P230  1  0.886965  0.607439  0.380172  1
  P  P231  1  0.783318  0.576962  0.417660  1
  P  P232  1  0.553631  0.607439  0.380172  1
  P  P233  1  0.616651  1.076962  0.417660  1
  P  P234  1  0.449984  0.576962  0.417660  1
  P  P235  1  0.386965  1.107439  0.380172  1
  P  P236  1  0.220298  0.607439  0.380172  1
  P  P237  1  0.283318  1.076962  0.417660  1
  P  P238  1  1.053631  1.107439  0.380172  1
  P  P239  1  0.949984  1.076962  0.417660  1
  P  P240  1  0.720298  1.107439  0.380172  1
  P  P241  1  0.079354  0.685217  0.438524  1
  P  P242  1  0.849570  0.715344  0.400842  1
  P  P243  1  0.746020  0.685217  0.438524  1
  P  P244  1  0.516237  0.715344  0.400842  1
  P  P245  1  0.579354  1.185217  0.438524  1
  P  P246  1  0.412687  0.685217  0.438524  1
  P  P247  1  0.349570  0.215344  0.400842  1
  P  P248  1  0.182903  0.715344  0.400842  1
  P  P249  1  0.246020  1.185217  0.438524  1
  P  P250  1  1.016237  0.215344  0.400842  1
  P  P251  1  0.912687  1.185217  0.438524  1
  P  P252  1  0.682903  0.215344  0.400842  1
  P  P253  1  1.001828  0.592228  0.398935  1
  P  P254  1  0.898265  0.561997  0.436524  1
  P  P255  1  0.668494  0.592228  0.398935  1
  P  P256  1  0.564932  0.561997  0.436524  1
  P  P257  1  0.501828  1.092228  0.398935  1
  P  P258  1  0.335161  0.592228  0.398935  1
  P  P259  1  0.398265  1.061997  0.436524  1
  P  P260  1  0.231598  0.561997  0.436524  1
  P  P261  1  0.168494  1.092228  0.398935  1
  P  P262  1  1.064932  1.061997  0.436524  1
  P  P263  1  0.835161  1.092228  0.398935  1
  P  P264  1  0.731598  1.061997  0.436524  1
  P  P265  1  0.990554  0.457741  0.410482  1
  P  P266  1  0.886675  0.427464  0.448083  1
  P  P267  1  0.657221  0.457741  0.410482  1
  P  P268  1  0.553342  0.427464  0.448083  1
  P  P269  1  0.490554  0.957741  0.410482  1
  P  P270  1  0.323887  0.457741  0.410482  1
  P  P271  1  0.386675  0.927464  0.448083  1
  P  P272  1  0.220009  0.427464  0.448083  1
  P  P273  1  0.157221  0.957741  0.410482  1
  P  P274  1  1.053342  0.927464  0.448083  1
  P  P275  1  0.823887  0.957741  0.410482  1
  P  P276  1  0.720009  0.927464  0.448083  1
  P  P277  1  0.091188  0.819775  0.426914  1
  P  P278  1  0.861682  0.849938  0.389224  1
  P  P279  1  0.757854  0.819775  0.426914  1
  P  P280  1  0.528349  0.849938  0.389224  1
  P  P281  1  0.591188  0.319775  0.426914  1
  P  P282  1  0.424521  0.819775  0.426914  1
  P  P283  1  0.361682  0.349938  0.389224  1
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