# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.84752064
_cell_length_b   126.03851587
_cell_length_c   50.29001488
_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   49741.3435315
_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  0.402739  0.290170  0.487615  1
  P  P2  1  0.354622  0.634273  0.353255  1
  P  P3  1  0.378567  0.962126  0.420817  1
  P  P4  1  0.546609  0.298596  0.430054  1
  P  P5  1  0.561912  0.626478  0.496231  1
  P  P6  1  0.520791  0.970160  0.361668  1
  P  P7  1  0.186817  0.099182  0.346040  1
  P  P8  1  0.180338  0.426586  0.410484  1
  P  P9  1  0.130703  0.754137  0.477536  1
  P  P10  1  0.845481  0.146754  0.455182  1
  P  P11  1  0.885883  0.491899  0.323294  1
  P  P12  1  0.862510  0.818702  0.387890  1
  P  P13  1  0.380260  0.154691  0.354214  1
  P  P14  1  0.356526  0.483287  0.421941  1
  P  P15  1  0.329717  0.810867  0.488964  1
  P  P16  1  0.601211  0.302418  0.336393  1
  P  P17  1  0.618408  0.630509  0.403535  1
  P  P18  1  0.643632  0.958104  0.471156  1
  P  P19  1  0.109503  0.166993  0.456620  1
  P  P20  1  0.151609  0.512179  0.325208  1
  P  P21  1  0.126103  0.838907  0.389365  1
  P  P22  1  0.646311  0.089974  0.443944  1
  P  P23  1  0.625997  0.417897  0.510260  1
  P  P24  1  0.661544  0.762138  0.377183  1
  P  P25  1  0.696131  0.171503  0.449360  1
  P  P26  1  0.672797  0.499709  0.517219  1
  P  P27  1  0.710796  0.843185  0.382370  1
  P  P28  1  0.964598  0.175001  0.398921  1
  P  P29  1  0.942623  0.503848  0.466428  1
  P  P30  1  0.979225  0.846933  0.332443  1
  P  P31  1  0.167819  0.147035  0.498102  1
  P  P32  1  0.215853  0.492056  0.364133  1
  P  P33  1  0.184401  0.819071  0.431142  1
  P  P34  1  0.116666  0.998950  0.473164  1
  P  P35  1  0.073802  0.342446  0.338463  1
  P  P36  1  0.091188  0.671487  0.405537  1
  P  P37  1  0.064999  0.258032  0.427823  1
  P  P38  1  0.082370  0.585905  0.494747  1
  P  P39  1  0.045146  0.929976  0.362429  1
  P  P40  1  0.020169  0.032108  0.338920  1
  P  P41  1  0.088062  0.358605  0.388509  1
  P  P42  1  0.096354  0.687144  0.457571  1
  P  P43  1  0.528967  0.267414  0.329514  1
  P  P44  1  0.560193  0.594142  0.393601  1
  P  P45  1  0.583857  0.921745  0.461391  1
  P  P46  1  0.960983  0.191392  0.448246  1
  P  P47  1  0.936107  0.519671  0.516871  1
  P  P48  1  0.972943  0.863076  0.382816  1
  P  P49  1  0.700686  0.154990  0.397220  1
  P  P50  1  0.678883  0.483513  0.465095  1
  P  P51  1  0.715839  0.826974  0.330609  1
  P  P52  1  0.051100  0.101802  0.503112  1
  P  P53  1  0.107142  0.446461  0.371390  1
  P  P54  1  0.067836  0.773945  0.436595  1
  P  P55  1  0.276969  0.302818  0.379402  1
  P  P56  1  0.296259  0.630579  0.446034  1
  P  P57  1  0.320519  0.958350  0.513227  1
  P  P58  1  0.595056  0.991779  0.324706  1
  P  P59  1  0.604843  0.318611  0.388041  1
  P  P60  1  0.620439  0.646954  0.455233  1
  P  P61  1  0.810426  0.278259  0.428445  1
  P  P62  1  0.825511  0.606046  0.494913  1
  P  P63  1  0.784959  0.950062  0.361700  1
  P  P64  1  0.869999  0.298295  0.386869  1
  P  P65  1  0.885094  0.626456  0.454092  1
  P  P66  1  0.849699  0.970454  0.322137  1
  P  P67  1  0.175898  0.114665  0.395284  1
  P  P68  1  0.153613  0.442643  0.461027  1
  P  P69  1  0.191878  0.786688  0.328259  1
  P  P70  1  0.376563  0.170968  0.406176  1
  P  P71  1  0.351431  0.499395  0.474236  1
  P  P72  1  0.391387  0.842847  0.338967  1
  P  P73  1  0.920597  0.094252  0.394492  1
  P  P74  1  0.904375  0.422121  0.460915  1
  P  P75  1  0.935854  0.766671  0.329393  1
  P  P76  1  0.444766  0.118858  0.344710  1
  P  P77  1  0.425917  0.447736  0.412142  1
  P  P78  1  0.392253  0.774085  0.478466  1
  P  P79  1  0.872488  0.019492  0.471140  1
  P  P80  1  0.814874  0.361839  0.340021  1
  P  P81  1  0.826655  0.691222  0.407879  1
  P  P82  1  0.376264  0.085918  0.493896  1
  P  P83  1  0.531028  0.429266  0.374150  1
  P  P84  1  0.392881  0.758056  0.427130  1
  P  P85  1  0.519673  0.986897  0.413801  1
  P  P86  1  0.550287  0.314952  0.481520  1
  P  P87  1  0.505044  0.658691  0.347138  1
  P  P88  1  0.250597  0.007570  0.415096  1
  P  P89  1  0.288271  0.335456  0.482730  1
  P  P90  1  0.247591  0.678758  0.348223  1
  P  P91  1  0.578391  0.142818  0.505548  1
  P  P92  1  0.625293  0.487586  0.371739  1
  P  P93  1  0.595666  0.814936  0.438607  1
  P  P94  1  0.116273  0.134339  0.352887  1
  P  P95  1  0.090647  0.462946  0.420523  1
  P  P96  1  0.066243  0.790306  0.487614  1
  P  P97  1  0.321223  0.027817  0.377059  1
  P  P98  1  0.345700  0.355072  0.440405  1
  P  P99  1  0.359303  0.683402  0.508019  1
  P  P100  1  0.540063  0.282842  0.378726  1
  P  P101  1  0.560155  0.610166  0.444858  1
  P  P102  1  0.583849  0.937984  0.512208  1
  P  P103  1  0.841408  0.163151  0.506939  1
  P  P104  1  0.888297  0.508049  0.373985  1
  P  P105  1  0.859266  0.835226  0.439945  1
  P  P106  1  0.429577  0.167717  0.499319  1
  P  P107  1  0.476708  0.512288  0.366410  1
  P  P108  1  0.446246  0.839665  0.432427  1
  P  P109  1  0.584293  0.109664  0.401759  1
  P  P110  1  0.562916  0.437566  0.468384  1
  P  P111  1  0.602168  0.782067  0.336013  1
  P  P112  1  0.968196  0.159029  0.347091  1
  P  P113  1  0.948479  0.487900  0.414393  1
  P  P114  1  0.917897  0.815072  0.481198  1
  P  P115  1  0.056367  0.979001  0.514285  1
  P  P116  1  0.014004  0.323079  0.380719  1
  P  P117  1  0.033771  0.651165  0.447307  1
  P  P118  1  0.133202  0.277642  0.385275  1
  P  P119  1  0.150121  0.605757  0.452985  1
  P  P120  1  0.108697  0.949899  0.322243  1
  P  P121  1  0.581059  0.126228  0.453766  1
  P  P122  1  0.628714  0.470743  0.322049  1
  P  P123  1  0.597633  0.798376  0.386883  1
  P  P124  1  0.814543  0.294460  0.480035  1
  P  P125  1  0.767022  0.638564  0.345896  1
  P  P126  1  0.785599  0.966257  0.412915  1
  P  P127  1  0.052862  0.085923  0.452463  1
  P  P128  1  0.190947  0.424451  0.344500  1
  P  P129  1  0.066891  0.757974  0.386368  1
  P  P130  1  0.853175  0.114053  0.352839  1
  P  P131  1  0.830648  0.441478  0.418992  1
  P  P132  1  0.802356  0.769586  0.486436  1
  P  P133  1  0.112834  0.982685  0.421881  1
  P  P134  1  0.139080  0.310661  0.489119  1
  P  P135  1  0.091252  0.654634  0.354323  1
  P  P136  1  0.526132  1.003498  0.465445  1
  P  P137  1  0.481934  0.347273  0.333555  1
  P  P138  1  0.505021  0.675326  0.398584  1
  P  P139  1  0.137093  0.294138  0.437133  1
  P  P140  1  0.150930  0.622306  0.503981  1
  P  P141  1  0.112412  0.966148  0.371170  1
  P  P142  1  0.439290  0.134673  0.395869  1
  P  P143  1  0.415601  0.463104  0.463562  1
  P  P144  1  0.454732  0.806668  0.329222  1
  P  P145  1  0.574414  0.023636  0.426972  1
  P  P146  1  0.617492  0.351318  0.490327  1
  P  P147  1  0.572667  0.694577  0.356975  1
  P  P148  1  0.380119  0.978670  0.472195  1
  P  P149  1  0.337363  0.322560  0.337479  1
  P  P150  1  0.354607  0.650950  0.404568  1
  P  P151  1  0.078270  0.274072  0.478513  1
  P  P152  1  0.029732  0.618362  0.344523  1
  P  P153  1  0.052556  0.946013  0.412076  1
  P  P154  1  0.905791  0.110251  0.444916  1
  P  P155  1  0.884284  0.438148  0.511206  1
  P  P156  1  0.923609  0.782511  0.378552  1
  P  P157  1  0.796530  0.262632  0.377691  1
  P  P158  1  0.824443  0.590233  0.443351  1
  P  P159  1  0.844292  0.917993  0.512152  1
  P  P160  1  0.366721  0.187285  0.456802  1
  P  P161  1  0.400843  0.531972  0.328080  1
  P  P162  1  0.382197  0.859111  0.389357  1
  P  P163  1  0.706933  0.138791  0.345767  1
  P  P164  1  0.687297  0.467642  0.413233  1
  P  P165  1  0.654616  0.794471  0.479637  1
  P  P166  1  0.929663  0.249827  0.485721  1
  P  P167  1  0.892666  0.594167  0.354666  1
  P  P168  1  0.907293  0.921670  0.419957  1
  P  P169  1  0.270798  0.287136  0.328224  1
  P  P170  1  0.294257  0.614195  0.394742  1
  P  P171  1  0.317961  0.941800  0.462141  1
  P  P172  1  0.844663  1.002986  0.423183  1
  P  P173  1  0.875687  0.331065  0.490296  1
  P  P174  1  0.826886  0.674732  0.355416  1
  P  P175  1  0.398909  0.273556  0.435758  1
  P  P176  1  0.413675  0.601609  0.502790  1
  P  P177  1  0.375551  0.945517  0.370135  1
  P  P178  1  0.320260  0.012228  0.326474  1
  P  P179  1  0.341409  0.338670  0.389538  1
  P  P180  1  0.357160  0.667313  0.456507  1
  P  P181  1  -0.008288  0.009496  0.362789  1
  P  P182  1  0.018929  0.339518  0.432235  1
  P  P183  1  0.034765  0.667514  0.498989  1
  P  P184  1  0.644264  0.174945  0.355840  1
  P  P185  1  0.619858  0.503610  0.423876  1
  P  P186  1  0.592405  0.831269  0.490272  1
  P  P187  1  0.636234  0.191011  0.406965  1
  P  P188  1  0.612826  0.519454  0.475511  1
  P  P189  1  0.656522  0.862445  0.341095  1
  P  P190  1  0.903050  0.126508  0.496478  1
  P  P191  1  0.958041  0.471886  0.362371  1
  P  P192  1  0.920123  0.798664  0.429769  1
  P  P193  1  0.788905  0.982877  0.464080  1
  P  P194  1  0.744385  0.327338  0.330808  1
  P  P195  1  0.769105  0.655025  0.397228  1
  P  P196  1  0.957763  0.027194  0.407131  1
  P  P197  1  0.026949  0.355329  0.483310  1
  P  P198  1  -0.013675  0.698084  0.352860  1
  P  P199  1  0.337250  0.253797  0.477640  1
  P  P200  1  0.292639  0.598487  0.344831  1
  P  P201  1  0.314022  0.925648  0.411651  1
  P  P202  1  0.664986  0.269691  0.485977  1
  P  P203  1  0.620520  0.614006  0.352661  1
  P  P204  1  0.641844  0.941507  0.419742  1
  P  P205  1  0.007659  0.307074  0.329244  1
  P  P206  1  0.031996  0.634645  0.395735  1
  P  P207  1  0.054739  0.962424  0.463060  1
  P  P208  1  0.847695  0.130335  0.403370  1
  P  P209  1  0.823547  0.458318  0.470246  1
  P  P210  1  0.864669  0.802351  0.336416  1
  P  P211  1  0.864080  0.282187  0.336149  1
  P  P212  1  0.885001  0.610244  0.403146  1
  P  P213  1  0.909282  0.937632  0.470574  1
  P  P214  1  0.230881  0.178992  0.349609  1
  P  P215  1  0.211689  0.508196  0.416457  1
  P  P216  1  0.181803  0.835668  0.482393  1
  P  P217  1  0.264600  0.990614  0.363254  1
  P  P218  1  0.282485  0.318968  0.431320  1
  P  P219  1  0.299026  0.647072  0.497702  1
  P  P220  1  0.583087  0.007823  0.375006  1
  P  P221  1  0.608862  0.335013  0.440063  1
  P  P222  1  0.623287  0.663409  0.506948  1
  P  P223  1  0.640802  0.105930  0.495004  1
  P  P224  1  0.709785  0.451806  0.363117  1
  P  P225  1  0.657192  0.778055  0.428161  1
  P  P226  1  0.113774  0.150580  0.404390  1
  P  P227  1  0.087814  0.478990  0.472313  1
  P  P228  1  0.128881  0.822578  0.337421  1
  P  P229  1  0.315944  0.122246  0.504212  1
  P  P230  1  0.364556  0.467121  0.369820  1
  P  P231  1  0.332567  0.794335  0.437241  1
  P  P232  1  0.793530  0.999850  0.514697  1
  P  P233  1  0.752108  0.343434  0.382490  1
  P  P234  1  0.769590  0.671507  0.448927  1
  P  P235  1  0.170574  0.130658  0.446556  1
  P  P236  1  0.146765  0.458620  0.513165  1
  P  P237  1  0.187408  0.802691  0.379281  1
  P  P238  1  0.843874  0.986208  0.372802  1
  P  P239  1  0.872397  0.314671  0.438690  1
  P  P240  1  0.886331  0.642894  0.505326  1
  P  P241  1  0.318653  0.105768  0.452484  1
  P  P242  1  0.396024  0.446543  0.327865  1
  P  P243  1  0.333536  0.777852  0.385359  1
  P  P244  1  0.095096  0.183364  0.506590  1
  P  P245  1  0.149330  0.527995  0.376481  1
  P  P246  1  0.115952  0.855306  0.440151  1
  P  P247  1  0.910666  0.194446  0.359887  1
  P  P248  1  0.880306  0.523579  0.425815  1
  P  P249  1  0.853793  0.851156  0.491133  1
  P  P250  1  0.434671  0.151011  0.447794  1
  P  P251  1  0.410357  0.479212  0.515258  1
  P  P252  1  0.449808  0.822972  0.380585  1
  P  P253  1  0.462206  0.274556  0.688399  1
  P  P254  1  0.416963  0.618294  0.554016  1
  P  P255  1  0.447578  0.946349  0.621735  1
  P  P256  1  0.612644  0.282297  0.630968  1
  P  P257  1  0.629888  0.610687  0.698058  1
  P  P258  1  0.587132  0.954577  0.563341  1
  P  P259  1  0.113457  0.082091  0.544403  1
  P  P260  1  0.086944  0.409667  0.609721  1
  P  P261  1  0.056584  0.738800  0.675649  1
  P  P262  1  0.779843  0.130555  0.656255  1
  P  P263  1  0.820485  0.474627  0.522371  1
  P  P264  1  0.796677  0.802589  0.588981  1
  P  P265  1  0.312635  0.138776  0.555900  1
  P  P266  1  0.279954  0.465605  0.622303  1
  P  P267  1  0.260318  0.794456  0.689769  1
  P  P268  1  0.668225  0.286175  0.537834  1
  P  P269  1  0.684765  0.614279  0.604217  1
  P  P270  1  0.702651  0.942632  0.672282  1
  P  P271  1  0.043642  0.150736  0.656985  1
  P  P272  1  0.082967  0.495099  0.524331  1
  P  P273  1  0.061460  0.822996  0.590620  1
  P  P274  1  0.585053  0.074136  0.646180  1
  P  P275  1  0.566408  0.401275  0.707457  1
  P  P276  1  0.600530  0.745961  0.578734  1
  P  P277  1  0.633715  0.155394  0.650177  1
  P  P278  1  0.571226  0.486704  0.707672  1
  P  P279  1  0.648598  0.827479  0.583052  1
  P  P280  1  0.899415  0.159302  0.598942  1
  P  P281  1  0.860108  0.486786  0.664147  1
  P  P282  1  0.916151  0.831444  0.532425  1
  P  P283  1  0.102581  0.130896  0.699120  1
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