# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.83474327
_cell_length_b   123.56037885
_cell_length_c   51.33803859
_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   P504
_cell_volume   49698.4991488
_cell_formula_units_Z   504
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  0.399245  0.340775  0.493373  1
  P  P2  1  0.357088  0.671163  0.358790  1
  P  P3  1  0.379540  1.005959  0.426158  1
  P  P4  1  0.542667  0.343226  0.433657  1
  P  P5  1  0.566096  0.678071  0.499782  1
  P  P6  1  0.519801  0.008574  0.365762  1
  P  P7  1  0.143020  0.136831  0.472286  1
  P  P8  1  0.201092  0.468023  0.341845  1
  P  P9  1  0.176866  0.802338  0.406295  1
  P  P10  1  0.875905  0.191400  0.347585  1
  P  P11  1  0.854031  0.526353  0.414521  1
  P  P12  1  0.832922  0.861172  0.482073  1
  P  P13  1  0.344340  0.193986  0.448021  1
  P  P14  1  0.322073  0.528790  0.515322  1
  P  P15  1  0.368340  0.858779  0.381636  1
  P  P16  1  0.595675  0.337529  0.342404  1
  P  P17  1  0.621947  0.672423  0.408953  1
  P  P18  1  0.644002  1.007227  0.476468  1
  P  P19  1  0.139310  0.211434  0.336316  1
  P  P20  1  0.118401  0.546413  0.403420  1
  P  P21  1  0.096576  0.881437  0.470708  1
  P  P22  1  0.678026  0.134132  0.374113  1
  P  P23  1  0.655784  0.469140  0.439539  1
  P  P24  1  0.635616  0.803866  0.506495  1
  P  P25  1  0.718688  0.214666  0.327051  1
  P  P26  1  0.703235  0.549949  0.394093  1
  P  P27  1  0.684026  0.885070  0.460998  1
  P  P28  1  0.929346  0.218855  0.477005  1
  P  P29  1  0.973315  0.548859  0.344456  1
  P  P30  1  0.952509  0.883663  0.410527  1
  P  P31  1  0.197059  0.196138  0.388072  1
  P  P32  1  0.176653  0.531052  0.455342  1
  P  P33  1  0.226298  0.861304  0.322549  1
  P  P34  1  0.117164  0.047910  0.453712  1
  P  P35  1  0.066693  0.377862  0.321624  1
  P  P36  1  0.094483  0.713201  0.385881  1
  P  P37  1  0.060671  0.302940  0.456598  1
  P  P38  1  0.014164  0.633336  0.327167  1
  P  P39  1  0.036571  0.968266  0.390386  1
  P  P40  1  0.122918  0.068860  0.492466  1
  P  P41  1  0.075319  0.398717  0.360326  1
  P  P42  1  0.101493  0.733975  0.425537  1
  P  P43  1  0.523729  0.302001  0.357885  1
  P  P44  1  0.558161  0.635647  0.423283  1
  P  P45  1  0.581829  0.970268  0.489506  1
  P  P46  1  0.979765  0.234247  0.319473  1
  P  P47  1  0.963833  0.569742  0.382780  1
  P  P48  1  0.947726  0.904668  0.448257  1
  P  P49  1  0.665374  0.198507  0.488367  1
  P  P50  1  0.710276  0.528786  0.354284  1
  P  P51  1  0.688798  0.863552  0.422044  1
  P  P52  1  0.082256  0.152359  0.421647  1
  P  P53  1  0.060593  0.486936  0.488333  1
  P  P54  1  0.110416  0.817411  0.354671  1
  P  P55  1  0.273096  0.342198  0.382964  1
  P  P56  1  0.299987  0.676950  0.449453  1
  P  P57  1  0.247350  1.007011  0.317333  1
  P  P58  1  0.646755  0.028790  0.515322  1
  P  P59  1  0.600489  0.358779  0.381636  1
  P  P60  1  0.624488  0.693986  0.448021  1
  P  P61  1  0.806523  0.323011  0.444659  1
  P  P62  1  0.829690  0.657792  0.510998  1
  P  P63  1  0.781262  0.988563  0.378314  1
  P  P64  1  0.865436  0.338543  0.392732  1
  P  P65  1  0.888946  0.673677  0.459637  1
  P  P66  1  0.840936  1.003356  0.326483  1
  P  P67  1  0.139138  0.157792  0.510998  1
  P  P68  1  0.187566  0.488563  0.378314  1
  P  P69  1  0.162306  0.823011  0.444659  1
  P  P70  1  0.340710  0.215519  0.487027  1
  P  P71  1  0.384147  0.545227  0.353160  1
  P  P72  1  0.363071  0.880291  0.420470  1
  P  P73  1  0.954664  0.133336  0.327167  1
  P  P74  1  0.932257  0.468266  0.390386  1
  P  P75  1  0.908158  0.802940  0.456598  1
  P  P76  1  0.405931  0.156789  0.461107  1
  P  P77  1  0.457296  0.487294  0.327818  1
  P  P78  1  0.432952  0.822412  0.394668  1
  P  P79  1  0.859975  0.067777  0.441692  1
  P  P80  1  0.884752  0.402638  0.508320  1
  P  P81  1  0.830804  0.733005  0.375990  1
  P  P82  1  0.410667  0.135647  0.423283  1
  P  P83  1  0.387000  0.470268  0.489506  1
  P  P84  1  0.445099  0.802001  0.357885  1
  P  P85  1  0.526400  0.029791  0.404823  1
  P  P86  1  0.546890  0.364684  0.472300  1
  P  P87  1  0.507529  0.694752  0.338236  1
  P  P88  1  0.265593  0.049949  0.394093  1
  P  P89  1  0.284802  0.385070  0.460998  1
  P  P90  1  0.250140  0.714666  0.327051  1
  P  P91  1  0.610748  0.192816  0.397497  1
  P  P92  1  0.587907  0.527663  0.464877  1
  P  P93  1  0.637492  0.857685  0.331453  1
  P  P94  1  0.079882  0.173677  0.459637  1
  P  P95  1  0.127892  0.503356  0.326483  1
  P  P96  1  0.103392  0.838543  0.392732  1
  P  P97  1  0.320332  0.064882  0.343254  1
  P  P98  1  0.344355  0.400114  0.408843  1
  P  P99  1  0.365060  0.735409  0.475662  1
  P  P100  1  0.535876  0.322412  0.394668  1
  P  P101  1  0.562897  0.656789  0.461107  1
  P  P102  1  0.511532  0.987294  0.327818  1
  P  P103  1  0.874345  0.213201  0.385881  1
  P  P104  1  0.851664  0.547910  0.453712  1
  P  P105  1  0.902135  0.877862  0.321624  1
  P  P106  1  0.460617  0.216378  0.376962  1
  P  P107  1  0.438826  0.551503  0.443794  1
  P  P108  1  0.417606  0.886386  0.510777  1
  P  P109  1  0.623257  0.149087  0.323691  1
  P  P110  1  0.595090  0.484301  0.387370  1
  P  P111  1  0.574009  0.819056  0.454458  1
  P  P112  1  0.931318  0.197441  0.438060  1
  P  P113  1  0.910347  0.532121  0.505244  1
  P  P114  1  0.957707  0.862420  0.371817  1
  P  P115  1  0.058481  0.032121  0.505244  1
  P  P116  1  0.011121  0.362420  0.371817  1
  P  P117  1  0.037510  0.697441  0.438060  1
  P  P118  1  0.128485  0.317948  0.404051  1
  P  P119  1  0.153754  0.653048  0.471288  1
  P  P120  1  0.102503  0.983418  0.338488  1
  P  P121  1  0.611740  0.171163  0.358790  1
  P  P122  1  0.589288  0.505959  0.426158  1
  P  P123  1  0.569583  0.840775  0.493373  1
  P  P124  1  0.811039  0.344275  0.483654  1
  P  P125  1  0.767482  0.674641  0.349405  1
  P  P126  1  0.788950  0.009686  0.416372  1
  P  P127  1  0.081794  0.131089  0.386131  1
  P  P128  1  0.062049  0.466003  0.450564  1
  P  P129  1  0.043723  0.800724  0.516504  1
  P  P130  1  0.815074  0.153048  0.471288  1
  P  P131  1  0.866325  0.483418  0.338488  1
  P  P132  1  0.840343  0.817948  0.404051  1
  P  P133  1  0.114797  0.026353  0.414521  1
  P  P134  1  0.135906  0.361172  0.482073  1
  P  P135  1  0.092923  0.691400  0.347585  1
  P  P136  1  0.530002  0.051503  0.443794  1
  P  P137  1  0.551223  0.386386  0.510777  1
  P  P138  1  0.508211  0.716378  0.376962  1
  P  P139  1  0.133307  0.339556  0.443017  1
  P  P140  1  0.155518  0.674650  0.509542  1
  P  P141  1  0.111855  1.004872  0.376219  1
  P  P142  1  0.402732  0.178071  0.499782  1
  P  P143  1  0.449027  0.508574  0.365762  1
  P  P144  1  0.426161  0.843226  0.433657  1
  P  P145  1  0.594854  0.066389  0.391042  1
  P  P146  1  0.613707  0.401493  0.458537  1
  P  P147  1  0.575014  0.731227  0.325774  1
  P  P148  1  0.380921  0.027663  0.464877  1
  P  P149  1  0.331336  0.357685  0.331453  1
  P  P150  1  0.358080  0.692816  0.397497  1
  P  P151  1  0.074540  0.323970  0.494753  1
  P  P152  1  0.028734  0.654625  0.361477  1
  P  P153  1  0.053078  0.989292  0.427951  1
  P  P154  1  0.940095  0.154625  0.361477  1
  P  P155  1  0.915750  0.489292  0.427951  1
  P  P156  1  0.894289  0.823970  0.494753  1
  P  P157  1  0.791962  0.302338  0.406295  1
  P  P158  1  0.825808  0.636831  0.472286  1
  P  P159  1  0.767736  0.968023  0.341845  1
  P  P160  1  0.393814  0.231227  0.325774  1
  P  P161  1  0.373974  0.566389  0.391042  1
  P  P162  1  0.355121  0.901493  0.458537  1
  P  P163  1  0.668842  0.176950  0.449453  1
  P  P164  1  0.721479  0.507011  0.317333  1
  P  P165  1  0.695732  0.842198  0.382964  1
  P  P166  1  0.925105  0.300724  0.516504  1
  P  P167  1  0.887034  0.631089  0.386131  1
  P  P168  1  0.906779  0.966003  0.450564  1
  P  P169  1  0.266905  0.321373  0.344195  1
  P  P170  1  0.297734  0.655549  0.410621  1
  P  P171  1  0.318689  0.990183  0.477940  1
  P  P172  1  0.850427  0.046413  0.403420  1
  P  P173  1  0.872252  0.381437  0.470708  1
  P  P174  1  0.829519  0.711434  0.336316  1
  P  P175  1  0.394819  0.319056  0.454458  1
  P  P176  1  0.345571  0.649087  0.323691  1
  P  P177  1  0.373738  0.984301  0.387370  1
  P  P178  1  0.384019  0.049039  0.503843  1
  P  P179  1  0.339560  0.379003  0.369749  1
  P  P180  1  0.361457  0.714246  0.436780  1
  P  P181  1  -0.004487  0.048859  0.344456  1
  P  P182  1  0.016320  0.383663  0.410527  1
  P  P183  1  0.039482  0.718855  0.477005  1
  P  P184  1  0.607371  0.214246  0.436780  1
  P  P185  1  0.584809  0.549039  0.503843  1
  P  P186  1  0.629268  0.879003  0.369749  1
  P  P187  1  0.603768  0.235409  0.475662  1
  P  P188  1  0.648496  0.564882  0.343254  1
  P  P189  1  0.624473  0.900114  0.408843  1
  P  P190  1  0.934234  0.175931  0.399411  1
  P  P191  1  0.912214  0.510652  0.466474  1
  P  P192  1  0.963842  0.841211  0.332841  1
  P  P193  1  0.792176  0.031052  0.455342  1
  P  P194  1  0.742530  0.361304  0.322549  1
  P  P195  1  0.771769  0.696138  0.388072  1
  P  P196  1  0.004995  0.069742  0.382780  1
  P  P197  1  0.021102  0.404668  0.448257  1
  P  P198  1  -0.010937  0.734247  0.319473  1
  P  P199  1  0.333212  0.303866  0.506495  1
  P  P200  1  0.290802  0.634132  0.374113  1
  P  P201  1  0.313044  0.969140  0.439539  1
  P  P202  1  0.661201  0.320390  0.504504  1
  P  P203  1  0.622023  0.650650  0.370717  1
  P  P204  1  0.640890  0.985600  0.437920  1
  P  P205  1  0.004986  0.341211  0.332841  1
  P  P206  1  0.034594  0.675931  0.399411  1
  P  P207  1  0.056614  0.010652  0.466474  1
  P  P208  1  0.813310  0.174650  0.509542  1
  P  P209  1  0.856973  0.504872  0.376219  1
  P  P210  1  0.835521  0.839556  0.443017  1
  P  P211  1  0.858412  0.317411  0.354671  1
  P  P212  1  0.886572  0.652359  0.421647  1
  P  P213  1  0.908235  0.986936  0.488333  1
  P  P214  1  0.195250  0.217693  0.427043  1
  P  P215  1  0.174377  0.552644  0.493710  1
  P  P216  1  0.220839  0.882649  0.360693  1
  P  P217  1  0.258552  0.028786  0.354284  1
  P  P218  1  0.280030  0.363552  0.422044  1
  P  P219  1  0.303454  0.698507  0.488367  1
  P  P220  1  0.584681  0.045227  0.353160  1
  P  P221  1  0.605757  0.380291  0.420470  1
  P  P222  1  0.628118  0.715519  0.487027  1
  P  P223  1  0.671094  0.155549  0.410621  1
  P  P224  1  0.650139  0.490183  0.477940  1
  P  P225  1  0.701923  0.821373  0.344195  1
  P  P226  1  0.077899  0.195123  0.498168  1
  P  P227  1  0.119510  0.525032  0.363681  1
  P  P228  1  0.100148  0.859945  0.431932  1
  P  P229  1  0.346881  0.172423  0.408953  1
  P  P230  1  0.324827  0.507227  0.476468  1
  P  P231  1  0.373153  0.837529  0.342404  1
  P  P232  1  0.794451  0.052644  0.493710  1
  P  P233  1  0.747989  0.382649  0.360693  1
  P  P234  1  0.773578  0.717693  0.427043  1
  P  P235  1  0.201346  0.174641  0.349405  1
  P  P236  1  0.179879  0.509686  0.416372  1
  P  P237  1  0.157789  0.844275  0.483654  1
  P  P238  1  0.849319  0.025032  0.363681  1
  P  P239  1  0.868680  0.359945  0.431932  1
  P  P240  1  0.890929  0.695123  0.498168  1
  P  P241  1  0.346806  0.150650  0.370717  1
  P  P242  1  0.327938  0.485600  0.437920  1
  P  P243  1  0.307627  0.820390  0.504504  1
  P  P244  1  0.138024  0.233005  0.375990  1
  P  P245  1  0.108853  0.567777  0.441692  1
  P  P246  1  0.084077  0.902638  0.508320  1
  P  P247  1  0.867335  0.233975  0.425537  1
  P  P248  1  0.845910  0.568860  0.492466  1
  P  P249  1  0.893509  0.898717  0.360326  1
  P  P250  1  0.461299  0.194752  0.338236  1
  P  P251  1  0.442428  0.529791  0.404823  1
  P  P252  1  0.421938  0.864684  0.472300  1
  P  P253  1  0.461299  0.345717  0.693685  1
  P  P254  1  0.421938  0.675784  0.559620  1
  P  P255  1  0.442428  0.010678  0.627098  1
  P  P256  1  0.610748  0.347653  0.634423  1
  P  P257  1  0.637492  0.682783  0.700467  1
  P  P258  1  0.587907  0.012806  0.567044  1
  P  P259  1  0.075319  0.141751  0.671595  1
  P  P260  1  0.122918  0.471608  0.539455  1
  P  P261  1  0.101493  0.806493  0.606384  1
  P  P262  1  0.811039  0.196194  0.548267  1
  P  P263  1  0.788950  0.530782  0.615549  1
  P  P264  1  0.767482  0.865827  0.682516  1
  P  P265  1  0.273096  0.198270  0.648957  1
  P  P266  1  0.247350  0.533458  0.714587  1
  P  P267  1  0.299987  0.863519  0.582467  1
  P  P268  1  0.665374  0.341962  0.543553  1
  P  P269  1  0.688798  0.676917  0.609877  1
  P  P270  1  0.710276  0.011682  0.677637  1
  P  P271  1  0.074540  0.216498  0.537167  1
  P  P272  1  0.053078  0.551177  0.603970  1
  P  P273  1  0.028734  0.885844  0.670443  1
  P  P274  1  0.613707  0.138975  0.573383  1
  P  P275  1  0.594854  0.474080  0.640879  1
  P  P276  1  0.575014  0.809241  0.706147  1
  P  P277  1  0.661201  0.220079  0.527416  1
  P  P278  1  0.640890  0.554869  0.594000  1
  P  P279  1  0.622023  0.889818  0.661203  1
  P  P280  1  0.858412  0.223057  0.677250  1
  P  P281  1  0.908235  0.553533  0.543588  1
  P  P282  1  0.886572  0.888110  0.610273  1
  P  P283  1  0.133307  0.200913  0.588904  1
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