# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   17.87108652
_cell_length_b   70.84284868
_cell_length_c   49.33998184
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   88.51454749
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P1008
_cell_volume   62445.3329082
_cell_formula_units_Z   1008
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  0.386848  0.933213  0.292598  1
  P  P2  1  0.057754  0.775144  0.290739  1
  P  P3  1  0.036321  0.944884  0.308509  1
  P  P4  1  0.386845  0.433213  0.292599  1
  P  P5  1  0.367219  0.603021  0.311454  1
  P  P6  1  0.342499  0.772940  0.330914  1
  P  P7  1  0.717679  0.590698  0.295172  1
  P  P8  1  0.697444  0.760616  0.314123  1
  P  P9  1  0.672215  0.930542  0.333341  1
  P  P10  1  0.057750  0.275144  0.290742  1
  P  P11  1  0.036318  0.444884  0.308510  1
  P  P12  1  0.012493  0.614591  0.328053  1
  P  P13  1  0.367219  1.103021  0.311455  1
  P  P14  1  0.342495  0.272941  0.330917  1
  P  P15  1  0.717679  1.090699  0.295173  1
  P  P16  1  0.697440  0.260616  0.314125  1
  P  P17  1  0.672211  0.430542  0.333342  1
  P  P18  1  0.012492  1.114591  0.328054  1
  P  P19  1  0.390464  1.058688  0.293015  1
  P  P20  1  0.060290  0.900458  0.290272  1
  P  P21  1  0.037386  1.069641  0.309384  1
  P  P22  1  0.390463  0.558687  0.293015  1
  P  P23  1  0.367100  0.728031  0.311521  1
  P  P24  1  0.341880  0.897832  0.330949  1
  P  P25  1  0.721487  0.716231  0.295543  1
  P  P26  1  0.697193  0.885613  0.313982  1
  P  P27  1  0.672548  1.055457  0.333555  1
  P  P28  1  0.060286  0.400458  0.290274  1
  P  P29  1  0.037385  0.569640  0.309384  1
  P  P30  1  0.013118  0.739715  0.328620  1
  P  P31  1  0.367097  0.228031  0.311523  1
  P  P32  1  0.341876  0.397832  0.330951  1
  P  P33  1  0.721484  0.216231  0.295545  1
  P  P34  1  0.697189  0.385613  0.313984  1
  P  P35  1  0.672547  0.555456  0.333554  1
  P  P36  1  0.013114  0.239715  0.328623  1
  P  P37  1  0.523697  1.030375  0.318354  1
  P  P38  1  0.193407  0.872594  0.316023  1
  P  P39  1  0.170523  1.042298  0.336008  1
  P  P40  1  0.523695  0.530374  0.318354  1
  P  P41  1  0.500431  0.700142  0.338135  1
  P  P42  1  0.547999  0.860821  0.299811  1
  P  P43  1  0.854037  0.687322  0.320813  1
  P  P44  1  0.830652  0.857355  0.340595  1
  P  P45  1  0.878802  1.017368  0.302273  1
  P  P46  1  0.193402  0.372593  0.316026  1
  P  P47  1  0.170521  0.542297  0.336009  1
  P  P48  1  0.217186  0.703146  0.297407  1
  P  P49  1  0.500428  0.200143  0.338137  1
  P  P50  1  0.547994  0.360820  0.299813  1
  P  P51  1  0.854034  0.187323  0.320815  1
  P  P52  1  0.830648  0.357355  0.340598  1
  P  P53  1  0.878800  0.517367  0.302273  1
  P  P54  1  0.217183  0.203146  0.297409  1
  P  P55  1  0.549700  0.985683  0.300180  1
  P  P56  1  0.218761  0.827972  0.297926  1
  P  P57  1  0.193628  0.997593  0.316294  1
  P  P58  1  0.549697  0.485682  0.300181  1
  P  P59  1  0.523119  0.655347  0.318540  1
  P  P60  1  0.568137  0.816989  0.280852  1
  P  P61  1  0.879842  0.642700  0.302453  1
  P  P62  1  0.854682  0.812410  0.320792  1
  P  P63  1  0.900933  0.972951  0.283614  1
  P  P64  1  0.218757  0.327972  0.297928  1
  P  P65  1  0.193625  0.497593  0.316295  1
  P  P66  1  0.237368  0.659331  0.278378  1
  P  P67  1  0.523117  0.155347  0.318541  1
  P  P68  1  0.568133  0.316989  0.280854  1
  P  P69  1  0.879841  0.142701  0.302454  1
  P  P70  1  0.854678  0.312410  0.320795  1
  P  P71  1  0.900930  0.472950  0.283615  1
  P  P72  1  0.237366  0.159332  0.278379  1
  P  P73  1  0.342498  1.022941  0.330915  1
  P  P74  1  0.012495  0.864591  0.328052  1
  P  P75  1  0.057753  1.025145  0.290740  1
  P  P76  1  0.342496  0.522940  0.330916  1
  P  P77  1  0.386847  0.683213  0.292597  1
  P  P78  1  0.367221  0.853021  0.311453  1
  P  P79  1  0.672214  0.680542  0.333341  1
  P  P80  1  0.717681  0.840698  0.295171  1
  P  P81  1  0.697443  1.010616  0.314124  1
  P  P82  1  0.012490  0.364591  0.328054  1
  P  P83  1  0.057751  0.525144  0.290741  1
  P  P84  1  0.036321  0.694884  0.308509  1
  P  P85  1  0.386845  0.183213  0.292599  1
  P  P86  1  0.367217  0.353021  0.311455  1
  P  P87  1  0.672212  0.180542  0.333343  1
  P  P88  1  0.717677  0.340698  0.295174  1
  P  P89  1  0.697441  0.510615  0.314124  1
  P  P90  1  0.036318  0.194884  0.308511  1
  P  P91  1  0.367100  0.978031  0.311522  1
  P  P92  1  0.037388  0.819641  0.309383  1
  P  P93  1  0.013117  0.989716  0.328621  1
  P  P94  1  0.367097  0.478030  0.311523  1
  P  P95  1  0.341879  0.647832  0.330949  1
  P  P96  1  0.390466  0.808687  0.293013  1
  P  P97  1  0.697192  0.635613  0.313982  1
  P  P98  1  0.672550  0.805456  0.333553  1
  P  P99  1  0.721487  0.966232  0.295544  1
  P  P100  1  0.037384  0.319641  0.309386  1
  P  P101  1  0.013115  0.489715  0.328622  1
  P  P102  1  0.060289  0.650458  0.290272  1
  P  P103  1  0.341877  0.147832  0.330951  1
  P  P104  1  0.390462  0.308687  0.293016  1
  P  P105  1  0.697191  0.135614  0.313984  1
  P  P106  1  0.672545  0.305456  0.333556  1
  P  P107  1  0.721484  0.466231  0.295545  1
  P  P108  1  0.060288  0.150458  0.290274  1
  P  P109  1  0.500431  0.950143  0.338135  1
  P  P110  1  0.170524  0.792297  0.336007  1
  P  P111  1  0.217186  0.953146  0.297407  1
  P  P112  1  0.500428  0.450142  0.338137  1
  P  P113  1  0.547997  0.610820  0.299811  1
  P  P114  1  0.523698  0.780374  0.318353  1
  P  P115  1  0.830651  0.607355  0.340596  1
  P  P116  1  0.878803  0.767368  0.302272  1
  P  P117  1  0.854037  0.937323  0.320813  1
  P  P118  1  0.170520  0.292297  0.336010  1
  P  P119  1  0.217183  0.453146  0.297409  1
  P  P120  1  0.193405  0.622593  0.316024  1
  P  P121  1  0.547996  1.110821  0.299812  1
  P  P122  1  0.523694  0.280374  0.318355  1
  P  P123  1  0.830650  1.107355  0.340597  1
  P  P124  1  0.878799  0.267368  0.302274  1
  P  P125  1  0.854034  0.437322  0.320814  1
  P  P126  1  0.193404  1.122594  0.316025  1
  P  P127  1  0.568135  1.066989  0.280853  1
  P  P128  1  0.237369  0.909332  0.278378  1
  P  P129  1  0.218759  1.077972  0.297927  1
  P  P130  1  0.568134  0.566989  0.280853  1
  P  P131  1  0.549700  0.735682  0.300179  1
  P  P132  1  0.523120  0.905347  0.318540  1
  P  P133  1  0.900933  0.722950  0.283613  1
  P  P134  1  0.879843  0.892701  0.302453  1
  P  P135  1  0.854681  1.062410  0.320794  1
  P  P136  1  0.237365  0.409331  0.278380  1
  P  P137  1  0.218758  0.577972  0.297927  1
  P  P138  1  0.193628  0.747593  0.316294  1
  P  P139  1  0.549697  0.235682  0.300182  1
  P  P140  1  0.523116  0.405347  0.318542  1
  P  P141  1  0.900930  0.222951  0.283615  1
  P  P142  1  0.879839  0.392700  0.302455  1
  P  P143  1  0.854680  0.562410  0.320793  1
  P  P144  1  0.193625  0.247593  0.316296  1
  P  P145  1  0.317590  0.942889  0.351432  1
  P  P146  1  0.987374  0.784887  0.349141  1
  P  P147  1  0.963207  0.954631  0.368233  1
  P  P148  1  0.317587  0.442888  0.351434  1
  P  P149  1  0.293019  0.612751  0.371117  1
  P  P150  1  0.269138  0.782597  0.391309  1
  P  P151  1  0.647916  0.600572  0.353989  1
  P  P152  1  0.623280  0.770517  0.373687  1
  P  P153  1  0.598814  0.940389  0.393760  1
  P  P154  1  0.987370  0.284887  0.349144  1
  P  P155  1  0.963204  0.454630  0.368235  1
  P  P156  1  0.938903  0.624526  0.388188  1
  P  P157  1  0.293018  1.112752  0.371118  1
  P  P158  1  0.269134  0.282597  0.391312  1
  P  P159  1  0.647916  1.100572  0.353990  1
  P  P160  1  0.623276  0.270517  0.373689  1
  P  P161  1  0.598811  0.440389  0.393762  1
  P  P162  1  0.938903  1.124526  0.388189  1
  P  P163  1  0.317785  1.067932  0.351927  1
  P  P164  1  0.987482  0.909798  0.348988  1
  P  P165  1  0.963183  1.079695  0.368586  1
  P  P166  1  0.317784  0.567932  0.351927  1
  P  P167  1  0.293240  0.737829  0.371021  1
  P  P168  1  0.269013  0.907549  0.391511  1
  P  P169  1  0.647741  0.725559  0.354408  1
  P  P170  1  0.623094  0.895584  0.373455  1
  P  P171  1  0.599623  1.065408  0.394172  1
  P  P172  1  0.987478  0.409797  0.348990  1
  P  P173  1  0.963182  0.579695  0.368585  1
  P  P174  1  0.939471  0.749703  0.388752  1
  P  P175  1  0.293236  0.237829  0.371023  1
  P  P176  1  0.269009  0.407549  0.391513  1
  P  P177  1  0.647738  0.225560  0.354410  1
  P  P178  1  0.623090  0.395583  0.373457  1
  P  P179  1  0.599622  0.565408  0.394172  1
  P  P180  1  0.939468  0.249703  0.388755  1
  P  P181  1  0.451020  1.040099  0.378522  1
  P  P182  1  0.120196  0.882098  0.376136  1
  P  P183  1  0.096589  1.052098  0.396444  1
  P  P184  1  0.451019  0.540098  0.378522  1
  P  P185  1  0.426915  0.710154  0.398509  1
  P  P186  1  0.474895  0.870387  0.359040  1
  P  P187  1  0.780824  0.697312  0.380941  1
  P  P188  1  0.756981  0.867457  0.401014  1
  P  P189  1  0.805593  1.027659  0.361526  1
  P  P190  1  0.120191  0.382098  0.376138  1
  P  P191  1  0.096587  0.552098  0.396445  1
  P  P192  1  0.144653  0.712408  0.356675  1
  P  P193  1  0.426912  0.210154  0.398511  1
  P  P194  1  0.474891  0.370387  0.359042  1
  P  P195  1  0.780821  0.197312  0.380943  1
  P  P196  1  0.756976  0.367457  0.401017  1
  P  P197  1  0.805591  0.527659  0.361526  1
  P  P198  1  0.144651  0.212408  0.356677  1
  P  P199  1  0.475227  0.995231  0.358811  1
  P  P200  1  0.144716  0.837304  0.356618  1
  P  P201  1  0.120844  1.007303  0.376175  1
  P  P202  1  0.475225  0.495230  0.358812  1
  P  P203  1  0.450723  0.665243  0.378354  1
  P  P204  1  0.499857  0.825451  0.339597  1
  P  P205  1  0.805205  0.652438  0.361250  1
  P  P206  1  0.781554  0.822536  0.380805  1
  P  P207  1  0.830054  0.982595  0.342110  1
  P  P208  1  0.144711  0.337303  0.356620  1
  P  P209  1  0.120841  0.507302  0.376176  1
  P  P210  1  0.168986  0.667627  0.337110  1
  P  P211  1  0.450720  0.165244  0.378356  1
  P  P212  1  0.499852  0.325451  0.339599  1
  P  P213  1  0.805203  0.152438  0.361251  1
  P  P214  1  0.781550  0.322536  0.380808  1
  P  P215  1  0.830052  0.482595  0.342111  1
  P  P216  1  0.168984  0.167627  0.337111  1
  P  P217  1  0.269137  1.032597  0.391310  1
  P  P218  1  0.938905  0.874526  0.388187  1
  P  P219  1  0.987373  1.034887  0.349142  1
  P  P220  1  0.269136  0.532597  0.391311  1
  P  P221  1  0.317590  0.692888  0.351432  1
  P  P222  1  0.293021  0.862751  0.371116  1
  P  P223  1  0.598814  0.690389  0.393760  1
  P  P224  1  0.647918  0.850572  0.353989  1
  P  P225  1  0.623279  1.020517  0.373688  1
  P  P226  1  0.938901  0.374526  0.388190  1
  P  P227  1  0.987371  0.534887  0.349143  1
  P  P228  1  0.963207  0.704630  0.368233  1
  P  P229  1  0.317587  0.192889  0.351434  1
  P  P230  1  0.293016  0.362751  0.371119  1
  P  P231  1  0.598811  0.190389  0.393762  1
  P  P232  1  0.647914  0.350572  0.353991  1
  P  P233  1  0.623277  0.520517  0.373688  1
  P  P234  1  0.963204  0.204630  0.368235  1
  P  P235  1  0.293239  0.987829  0.371022  1
  P  P236  1  0.963185  0.829695  0.368584  1
  P  P237  1  0.939471  0.999703  0.388753  1
  P  P238  1  0.293237  0.487829  0.371023  1
  P  P239  1  0.269012  0.657549  0.391511  1
  P  P240  1  0.317786  0.817932  0.351926  1
  P  P241  1  0.623093  0.645583  0.373455  1
  P  P242  1  0.599625  0.815408  0.394171  1
  P  P243  1  0.647741  0.975560  0.354409  1
  P  P244  1  0.963181  0.329695  0.368587  1
  P  P245  1  0.939468  0.499703  0.388754  1
  P  P246  1  0.987481  0.659797  0.348988  1
  P  P247  1  0.269010  0.157549  0.391513  1
  P  P248  1  0.317782  0.317932  0.351929  1
  P  P249  1  0.623091  0.145584  0.373457  1
  P  P250  1  0.599620  0.315408  0.394173  1
  P  P251  1  0.647739  0.475559  0.354410  1
  P  P252  1  0.987479  0.159797  0.348989  1
  P  P253  1  0.426915  0.960154  0.398509  1
  P  P254  1  0.096590  0.802098  0.396443  1
  P  P255  1  0.144654  0.962408  0.356675  1
  P  P256  1  0.426912  0.460154  0.398510  1
  P  P257  1  0.474893  0.620387  0.359041  1
  P  P258  1  0.451021  0.790098  0.378521  1
  P  P259  1  0.756979  0.617457  0.401015  1
  P  P260  1  0.805594  0.777659  0.361525  1
  P  P261  1  0.780824  0.947312  0.380941  1
  P  P262  1  0.096586  0.302098  0.396446  1
  P  P263  1  0.144650  0.462407  0.356677  1
  P  P264  1  0.120194  0.632098  0.376137  1
  P  P265  1  0.474892  1.120387  0.359042  1
  P  P266  1  0.451017  0.290098  0.378524  1
  P  P267  1  0.756978  1.117457  0.401016  1
  P  P268  1  0.805590  0.277659  0.361527  1
  P  P269  1  0.780821  0.447312  0.380943  1
  P  P270  1  0.120193  1.132098  0.376138  1
  P  P271  1  0.499855  1.075451  0.339598  1
  P  P272  1  0.168987  0.917627  0.337110  1
  P  P273  1  0.144714  1.087304  0.356619  1
  P  P274  1  0.499854  0.575451  0.339598  1
  P  P275  1  0.475228  0.745230  0.358810  1
  P  P276  1  0.450723  0.915244  0.378354  1
  P  P277  1  0.830055  0.732595  0.342110  1
  P  P278  1  0.805206  0.902438  0.361250  1
  P  P279  1  0.781552  1.072536  0.380807  1
  P  P280  1  0.168983  0.417627  0.337112  1
  P  P281  1  0.144713  0.587303  0.356619  1
  P  P282  1  0.120844  0.757303  0.376174  1
  P  P283  1  0.475224  0.245230  0.358813  1
  P  P284  1  0.450720  0.415243  0.378356  1
  P  P285  1  0.830051  0.232595  0.342112  1
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  P  P866  1  0.617735  0.837584  0.648194  1
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  P  P901  1  0.085553  1.089714  0.678952  1
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  P  P905  1  0.067634  0.759910  0.697262  1
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  P  P913  1  0.067630  0.259912  0.697263  1
  P  P914  1  0.108186  0.419987  0.659436  1
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  P  P918  1  0.777939  0.250424  0.661647  1
  P  P919  1  0.111306  1.045194  0.659200  1
  P  P920  1  0.777534  0.874366  0.663169  1
  P  P921  1  0.753005  1.044429  0.681021  1
  P  P922  1  0.111308  0.545196  0.659200  1
  P  P923  1  0.085413  0.715006  0.679045  1
  P  P924  1  0.134421  0.874920  0.639775  1
  P  P925  1  0.438081  0.704206  0.662221  1
  P  P926  1  0.416911  0.874148  0.680923  1
  P  P927  1  0.463555  1.034569  0.642888  1
  P  P928  1  0.777522  0.374346  0.663175  1
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  P  P930  1  0.798266  0.706692  0.640688  1
  P  P931  1  0.085408  0.215008  0.679046  1
  P  P932  1  0.134421  0.374922  0.639777  1
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  P  P934  1  0.416909  0.374149  0.680924  1
  P  P935  1  0.463555  0.534570  0.642888  1
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  P  P948  1  0.598234  0.758361  0.669434  1
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  P  P977  1  0.108189  0.669986  0.659435  1
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  P  P1008  1  0.752990  0.294415  0.681025  1
