# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   51.58897884
_cell_length_b   49.51713726
_cell_length_c   55.35253682
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   84.22110730
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P648
_cell_volume   140681.574748
_cell_formula_units_Z   648
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  0.951476  0.433312  0.307979  1
  P  P2  1  0.320872  0.431267  0.403217  1
  P  P3  1  0.284809  0.099979  0.307979  1
  P  P4  1  0.636174  0.432290  0.355598  1
  P  P5  1  0.654205  0.097934  0.403217  1
  P  P6  1  0.618143  0.766645  0.307979  1
  P  P7  1  0.969507  0.098956  0.355598  1
  P  P8  1  0.987539  0.764601  0.403217  1
  P  P9  1  0.302841  0.765623  0.355598  1
  P  P10  1  0.951299  0.556737  0.311449  1
  P  P11  1  0.321045  0.553888  0.406660  1
  P  P12  1  0.284633  0.223403  0.311449  1
  P  P13  1  0.636347  0.554910  0.359041  1
  P  P14  1  0.654378  0.220554  0.406660  1
  P  P15  1  0.617966  0.890070  0.311449  1
  P  P16  1  0.969680  0.221577  0.359041  1
  P  P17  1  0.987712  0.887221  0.406660  1
  P  P18  1  0.303014  0.888243  0.359041  1
  P  P19  1  0.950126  0.389567  0.348890  1
  P  P20  1  0.265457  0.390607  0.301259  1
  P  P21  1  0.283460  0.056234  0.348890  1
  P  P22  1  0.634824  0.388545  0.396509  1
  P  P23  1  0.598791  0.057274  0.301259  1
  P  P24  1  0.616793  0.722900  0.348890  1
  P  P25  1  0.968157  0.055211  0.396509  1
  P  P26  1  0.932124  0.723941  0.301259  1
  P  P27  1  0.301491  0.721878  0.396509  1
  P  P28  1  0.007093  0.596610  0.413368  1
  P  P29  1  0.322395  0.597633  0.365749  1
  P  P30  1  0.340426  0.263277  0.413368  1
  P  P31  1  0.637697  0.598655  0.318130  1
  P  P32  1  0.655728  0.264299  0.365749  1
  P  P33  1  0.673759  0.929944  0.413368  1
  P  P34  1  0.971030  0.265322  0.318130  1
  P  P35  1  0.989062  0.930966  0.365749  1
  P  P36  1  0.304364  0.931988  0.318130  1
  P  P37  1  1.000262  0.391312  0.317013  1
  P  P38  1  0.369657  0.389268  0.412251  1
  P  P39  1  0.333595  0.057979  0.317013  1
  P  P40  1  0.684960  0.390290  0.364632  1
  P  P41  1  0.702991  0.055934  0.412251  1
  P  P42  1  0.666928  0.724646  0.317013  1
  P  P43  1  0.018293  0.056957  0.364632  1
  P  P44  1  0.036324  0.722601  0.412251  1
  P  P45  1  0.351626  0.723623  0.364632  1
  P  P46  1  0.903649  0.597767  0.302611  1
  P  P47  1  0.272260  0.595888  0.397626  1
  P  P48  1  0.236982  0.264433  0.302611  1
  P  P49  1  0.587562  0.596910  0.350007  1
  P  P50  1  0.605593  0.262554  0.397626  1
  P  P51  1  0.570315  0.931100  0.302611  1
  P  P52  1  0.920895  0.263577  0.350007  1
  P  P53  1  0.938926  0.929221  0.397626  1
  P  P54  1  0.254228  0.930243  0.350007  1
  P  P55  1  0.949448  0.372001  0.294417  1
  P  P56  1  0.318844  0.369956  0.389655  1
  P  P57  1  0.282781  0.038667  0.294417  1
  P  P58  1  0.634146  0.370978  0.342036  1
  P  P59  1  0.652177  0.036623  0.389655  1
  P  P60  1  0.616115  0.705334  0.294417  1
  P  P61  1  0.967479  0.037645  0.342036  1
  P  P62  1  0.985510  0.703289  0.389655  1
  P  P63  1  0.300812  0.704312  0.342036  1
  P  P64  1  0.953271  0.616623  0.324721  1
  P  P65  1  0.323073  0.615199  0.420222  1
  P  P66  1  0.286604  0.283290  0.324721  1
  P  P67  1  0.638375  0.616221  0.372603  1
  P  P68  1  0.656407  0.281866  0.420222  1
  P  P69  1  0.619938  0.949956  0.324721  1
  P  P70  1  0.971709  0.282888  0.372603  1
  P  P71  1  0.989740  0.948532  0.420222  1
  P  P72  1  0.305042  0.949555  0.372603  1
  P  P73  1  0.081852  0.475090  0.327918  1
  P  P74  1  0.451247  0.473045  0.423156  1
  P  P75  1  0.415185  0.141757  0.327918  1
  P  P76  1  0.766550  0.474068  0.375537  1
  P  P77  1  0.784581  0.139712  0.423156  1
  P  P78  1  0.748518  0.808423  0.327918  1
  P  P79  1  0.099883  0.140734  0.375537  1
  P  P80  1  0.117914  0.806379  0.423156  1
  P  P81  1  0.433216  0.807401  0.375537  1
  P  P82  1  0.821303  0.514160  0.291471  1
  P  P83  1  0.190670  0.512110  0.386720  1
  P  P84  1  0.154636  0.180826  0.291471  1
  P  P85  1  0.505972  0.513132  0.339101  1
  P  P86  1  0.524003  0.178777  0.386720  1
  P  P87  1  0.487970  0.847493  0.291471  1
  P  P88  1  0.839305  0.179799  0.339101  1
  P  P89  1  0.857336  0.845443  0.386720  1
  P  P90  1  0.172638  0.846466  0.339101  1
  P  P91  1  0.031986  0.482097  0.360722  1
  P  P92  1  0.348066  0.482901  0.313326  1
  P  P93  1  0.365319  0.148763  0.360722  1
  P  P94  1  0.716684  0.481074  0.408341  1
  P  P95  1  0.681400  0.149567  0.313326  1
  P  P96  1  0.698653  0.815430  0.360722  1
  P  P97  1  0.050017  0.147741  0.408341  1
  P  P98  1  0.014733  0.816234  0.313326  1
  P  P99  1  0.383350  0.814408  0.408341  1
  P  P100  1  0.925233  0.504081  0.401536  1
  P  P101  1  0.240535  0.505103  0.353917  1
  P  P102  1  0.258567  0.170747  0.401536  1
  P  P103  1  0.555837  0.506126  0.306298  1
  P  P104  1  0.573869  0.171770  0.353917  1
  P  P105  1  0.591900  0.837414  0.401536  1
  P  P106  1  0.889171  0.172792  0.306298  1
  P  P107  1  0.907202  0.838437  0.353917  1
  P  P108  1  0.222504  0.839459  0.306298  1
  P  P109  1  0.077387  0.437046  0.372779  1
  P  P110  1  0.392408  0.438892  0.325124  1
  P  P111  1  0.410720  0.103712  0.372779  1
  P  P112  1  0.762084  0.436023  0.420398  1
  P  P113  1  0.725741  0.105558  0.325124  1
  P  P114  1  0.744053  0.770379  0.372779  1
  P  P115  1  0.095418  0.102690  0.420398  1
  P  P116  1  0.059075  0.772225  0.325124  1
  P  P117  1  0.428751  0.769357  0.420398  1
  P  P118  1  0.879833  0.549132  0.389478  1
  P  P119  1  0.195135  0.550154  0.341859  1
  P  P120  1  0.213166  0.215798  0.389478  1
  P  P121  1  0.510437  0.551176  0.294240  1
  P  P122  1  0.528468  0.216821  0.341859  1
  P  P123  1  0.546499  0.882465  0.389478  1
  P  P124  1  0.843770  0.217843  0.294240  1
  P  P125  1  0.861801  0.883487  0.341859  1
  P  P126  1  0.177103  0.884510  0.294240  1
  P  P127  1  0.085280  0.498507  0.380398  1
  P  P128  1  0.400113  0.498929  0.332580  1
  P  P129  1  0.418613  0.165174  0.380398  1
  P  P130  1  0.769978  0.497485  0.428017  1
  P  P131  1  0.733446  0.165596  0.332580  1
  P  P132  1  0.751946  0.831841  0.380398  1
  P  P133  1  0.103311  0.164152  0.428017  1
  P  P134  1  0.066780  0.832263  0.332580  1
  P  P135  1  0.436644  0.830818  0.428017  1
  P  P136  1  0.871939  0.487670  0.381860  1
  P  P137  1  0.187242  0.488693  0.334241  1
  P  P138  1  0.205273  0.154337  0.381860  1
  P  P139  1  0.502544  0.489715  0.286622  1
  P  P140  1  0.520575  0.155359  0.334241  1
  P  P141  1  0.538606  0.821004  0.381860  1
  P  P142  1  0.835877  0.156382  0.286622  1
  P  P143  1  0.853908  0.822026  0.334241  1
  P  P144  1  0.169210  0.823048  0.286622  1
  P  P145  1  0.844199  0.339425  0.304071  1
  P  P146  1  0.213595  0.337380  0.399309  1
  P  P147  1  0.177533  0.006092  0.304071  1
  P  P148  1  0.528897  0.338403  0.351690  1
  P  P149  1  0.546928  0.004047  0.399309  1
  P  P150  1  0.510866  0.672759  0.304071  1
  P  P151  1  0.862230  0.005070  0.351690  1
  P  P152  1  0.880262  0.670714  0.399309  1
  P  P153  1  0.195564  0.671736  0.351690  1
  P  P154  1  0.059330  0.649059  0.315203  1
  P  P155  1  0.428322  0.647775  0.410568  1
  P  P156  1  0.392663  0.315725  0.315203  1
  P  P157  1  0.743624  0.648797  0.362949  1
  P  P158  1  0.761655  0.314441  0.410568  1
  P  P159  1  0.725997  0.982392  0.315203  1
  P  P160  1  0.076957  0.315464  0.362949  1
  P  P161  1  0.094989  0.981108  0.410568  1
  P  P162  1  0.410291  0.982130  0.362949  1
  P  P163  1  0.843814  0.371073  0.353234  1
  P  P164  1  0.159086  0.372098  0.305603  1
  P  P165  1  0.177147  0.037740  0.353234  1
  P  P166  1  0.528512  0.370051  0.400853  1
  P  P167  1  0.492420  0.038764  0.305603  1
  P  P168  1  0.510481  0.704406  0.353234  1
  P  P169  1  0.861845  0.036717  0.400853  1
  P  P170  1  0.825753  0.705431  0.305603  1
  P  P171  1  0.195178  0.703384  0.400853  1
  P  P172  1  0.113405  0.615104  0.409024  1
  P  P173  1  0.428707  0.616127  0.361405  1
  P  P174  1  0.446738  0.281771  0.409024  1
  P  P175  1  0.744009  0.617149  0.313785  1
  P  P176  1  0.762041  0.282793  0.361405  1
  P  P177  1  0.780072  0.948438  0.409024  1
  P  P178  1  0.077343  0.283816  0.313785  1
  P  P179  1  0.095374  0.949460  0.361405  1
  P  P180  1  0.410676  0.950483  0.313785  1
  P  P181  1  0.793402  0.374452  0.321163  1
  P  P182  1  0.162798  0.372407  0.416401  1
  P  P183  1  0.126735  0.041119  0.321163  1
  P  P184  1  0.478100  0.373430  0.368782  1
  P  P185  1  0.496131  0.039074  0.416401  1
  P  P186  1  0.460068  0.707785  0.321163  1
  P  P187  1  0.811433  0.040096  0.368782  1
  P  P188  1  0.829464  0.705741  0.416401  1
  P  P189  1  0.144766  0.706763  0.368782  1
  P  P190  1  0.108940  0.614844  0.298478  1
  P  P191  1  0.479119  0.612748  0.393476  1
  P  P192  1  0.442273  0.281510  0.298478  1
  P  P193  1  0.794421  0.613770  0.345857  1
  P  P194  1  0.812453  0.279415  0.393476  1
  P  P195  1  0.775606  0.948177  0.298478  1
  P  P196  1  0.127755  0.280437  0.345857  1
  P  P197  1  0.145786  0.946081  0.393476  1
  P  P198  1  0.461088  0.947104  0.345857  1
  P  P199  1  0.841890  0.403021  0.304174  1
  P  P200  1  0.211286  0.400977  0.399412  1
  P  P201  1  0.175223  0.069688  0.304174  1
  P  P202  1  0.526588  0.401999  0.351793  1
  P  P203  1  0.544619  0.067643  0.399412  1
  P  P204  1  0.508556  0.736355  0.304174  1
  P  P205  1  0.859921  0.068666  0.351793  1
  P  P206  1  0.877952  0.734310  0.399412  1
  P  P207  1  0.193254  0.735332  0.351793  1
  P  P208  1  0.061586  0.586935  0.315102  1
  P  P209  1  0.430631  0.584179  0.410465  1
  P  P210  1  0.394919  0.253602  0.315102  1
  P  P211  1  0.745934  0.585201  0.362846  1
  P  P212  1  0.763965  0.250845  0.410465  1
  P  P213  1  0.728253  0.920268  0.315102  1
  P  P214  1  0.079267  0.251868  0.362846  1
  P  P215  1  0.097298  0.917512  0.410465  1
  P  P216  1  0.412600  0.918534  0.362846  1
  P  P217  1  0.005570  0.430245  0.450836  1
  P  P218  1  0.374966  0.428200  0.546074  1
  P  P219  1  0.338903  0.096912  0.450836  1
  P  P220  1  0.690268  0.429223  0.498455  1
  P  P221  1  0.708299  0.094867  0.546074  1
  P  P222  1  0.672237  0.763578  0.450836  1
  P  P223  1  0.023601  0.095889  0.498455  1
  P  P224  1  0.041632  0.761534  0.546074  1
  P  P225  1  0.356934  0.762556  0.498455  1
  P  P226  1  0.005743  0.552865  0.454279  1
  P  P227  1  0.375139  0.550821  0.549517  1
  P  P228  1  0.339076  0.219532  0.454279  1
  P  P229  1  0.690441  0.551843  0.501898  1
  P  P230  1  0.708472  0.217487  0.549517  1
  P  P231  1  0.672410  0.886199  0.454279  1
  P  P232  1  0.023774  0.218510  0.501898  1
  P  P233  1  0.041805  0.884154  0.549517  1
  P  P234  1  0.357108  0.885176  0.501898  1
  P  P235  1  0.004220  0.386500  0.491747  1
  P  P236  1  0.319522  0.387522  0.444128  1
  P  P237  1  0.337553  0.053167  0.491747  1
  P  P238  1  0.688918  0.385478  0.539366  1
  P  P239  1  0.652855  0.054189  0.444128  1
  P  P240  1  0.670887  0.719833  0.491747  1
  P  P241  1  0.022251  0.052144  0.539366  1
  P  P242  1  0.986189  0.720856  0.444128  1
  P  P243  1  0.355585  0.718811  0.539366  1
  P  P244  1  0.061187  0.593543  0.556225  1
  P  P245  1  0.376489  0.594566  0.508606  1
  P  P246  1  0.394520  0.260210  0.556225  1
  P  P247  1  0.691791  0.595588  0.460987  1
  P  P248  1  0.709822  0.261232  0.508606  1
  P  P249  1  0.727853  0.926877  0.556225  1
  P  P250  1  0.025124  0.262255  0.460987  1
  P  P251  1  0.043155  0.927899  0.508606  1
  P  P252  1  0.358457  0.928921  0.460987  1
  P  P253  1  0.054355  0.388245  0.459870  1
  P  P254  1  0.423751  0.386200  0.555108  1
  P  P255  1  0.387689  0.054912  0.459870  1
  P  P256  1  0.739053  0.387223  0.507489  1
  P  P257  1  0.757085  0.052867  0.555108  1
  P  P258  1  0.721022  0.721578  0.459870  1
  P  P259  1  0.072387  0.053889  0.507489  1
  P  P260  1  0.090418  0.719534  0.555108  1
  P  P261  1  0.405720  0.720556  0.507489  1
  P  P262  1  0.956957  0.594865  0.445245  1
  P  P263  1  0.326353  0.592821  0.540483  1
  P  P264  1  0.290291  0.261532  0.445245  1
  P  P265  1  0.641655  0.593843  0.492864  1
  P  P266  1  0.659687  0.259487  0.540483  1
  P  P267  1  0.623624  0.928199  0.445245  1
  P  P268  1  0.974989  0.260510  0.492864  1
  P  P269  1  0.993020  0.926154  0.540483  1
  P  P270  1  0.308322  0.927176  0.492864  1
  P  P271  1  0.003542  0.368934  0.437274  1
  P  P272  1  0.372937  0.366889  0.532512  1
  P  P273  1  0.336875  0.035600  0.437274  1
  P  P274  1  0.688240  0.367911  0.484893  1
  P  P275  1  0.706271  0.033556  0.532512  1
  P  P276  1  0.670208  0.702267  0.437274  1
  P  P277  1  0.021573  0.034578  0.484893  1
  P  P278  1  0.039604  0.700222  0.532512  1
  P  P279  1  0.354906  0.701245  0.484893  1
  P  P280  1  0.007771  0.614177  0.467841  1
  P  P281  1  0.377167  0.612132  0.563079  1
  P  P282  1  0.341104  0.280843  0.467841  1
  P  P283  1  0.692469  0.613154  0.515460  1
  P  P284  1  0.710500  0.278799  0.563079  1
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