# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.94202636
_cell_length_b   42.15326448
_cell_length_c   55.50174858
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   83.39132850
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P336
_cell_volume   30077.7121263
_cell_formula_units_Z   336
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  0.628324  0.064798  0.273821  1
  P  P2  1  0.879637  0.057781  0.288073  1
  P  P3  1  0.478261  0.681841  0.302615  1
  P  P4  1  0.165702  0.509654  0.296419  1
  P  P5  1  0.667929  0.505220  0.297730  1
  P  P6  1  0.189950  0.071470  0.329752  1
  P  P7  1  0.936442  0.456509  0.385532  1
  P  P8  1  0.977233  0.681257  0.300924  1
  P  P9  1  0.177817  0.444078  0.327155  1
  P  P10  1  0.425442  0.436509  0.332057  1
  P  P11  1  0.787789  0.504380  0.348972  1
  P  P12  1  0.461289  0.947245  0.292819  1
  P  P13  1  0.606023  0.179974  0.325085  1
  P  P14  1  0.350315  0.887742  0.275376  1
  P  P15  1  0.112580  0.179935  0.325380  1
  P  P16  1  0.290743  0.373903  0.324471  1
  P  P17  1  0.288496  0.504930  0.349167  1
  P  P18  1  0.618389  0.632709  0.337925  1
  P  P19  1  0.943903  0.063629  0.344541  1
  P  P20  1  0.073682  0.008469  0.310593  1
  P  P21  1  0.557399  0.126524  0.363104  1
  P  P22  1  0.127574  0.064607  0.274485  1
  P  P23  1  0.376677  0.619896  0.281029  1
  P  P24  1  0.183193  0.456733  0.385932  1
  P  P25  1  0.227700  0.681339  0.300857  1
  P  P26  1  0.624852  0.619547  0.280695  1
  P  P27  1  0.416167  0.892269  0.330502  1
  P  P28  1  0.726337  0.681991  0.301341  1
  P  P29  1  0.395200  0.007172  0.383239  1
  P  P30  1  0.713526  0.940595  0.307859  1
  P  P31  1  0.917628  0.507289  0.297160  1
  P  P32  1  0.518102  0.568991  0.316682  1
  P  P33  1  0.909383  0.891330  0.332525  1
  P  P34  1  0.993176  0.119711  0.306101  1
  P  P35  1  0.686666  0.455804  0.386934  1
  P  P36  1  0.927877  0.441362  0.327904  1
  P  P37  1  0.119158  0.635076  0.338261  1
  P  P38  1  0.538584  0.503663  0.349455  1
  P  P39  1  0.895423  0.007080  0.383228  1
  P  P40  1  0.806861  0.134323  0.347304  1
  P  P41  1  0.017316  0.571974  0.317316  1
  P  P42  1  0.443975  0.062977  0.344530  1
  P  P43  1  0.703006  0.695993  0.359230  1
  P  P44  1  0.368739  0.634037  0.338309  1
  P  P45  1  0.574553  0.009976  0.310425  1
  P  P46  1  0.281407  0.944597  0.364829  1
  P  P47  1  0.691212  0.072076  0.329567  1
  P  P48  1  0.142925  0.568996  0.369652  1
  P  P49  1  0.836826  0.883906  0.279278  1
  P  P50  1  0.142537  0.014922  0.367604  1
  P  P51  1  0.492541  0.119070  0.305969  1
  P  P52  1  0.126245  0.619299  0.280726  1
  P  P53  1  0.676569  0.186598  0.381806  1
  P  P54  1  0.087519  0.393566  0.362735  1
  P  P55  1  0.393337  0.568437  0.369822  1
  P  P56  1  0.356372  0.188005  0.315138  1
  P  P57  1  0.057946  0.126249  0.363445  1
  P  P58  1  0.526588  0.954477  0.348980  1
  P  P59  1  0.739621  0.126802  0.291499  1
  P  P60  1  0.027389  0.952851  0.349321  1
  P  P61  1  0.779205  0.944981  0.365302  1
  P  P62  1  0.436251  0.457364  0.387538  1
  P  P63  1  0.333437  0.393006  0.377131  1
  P  P64  1  0.641782  0.567810  0.369787  1
  P  P65  1  0.325883  0.001024  0.325612  1
  P  P66  1  0.663613  0.884932  0.343613  1
  P  P67  1  0.175448  0.187275  0.381878  1
  P  P68  1  0.306253  0.132341  0.349050  1
  P  P69  1  0.378684  0.057269  0.287843  1
  P  P70  1  0.269423  0.570687  0.317099  1
  P  P71  1  0.241874  0.127129  0.292192  1
  P  P72  1  0.677387  0.439828  0.329616  1
  P  P73  1  0.828357  0.001263  0.325936  1
  P  P74  1  0.959906  0.944829  0.293522  1
  P  P75  1  0.874484  0.619734  0.280969  1
  P  P76  1  0.417338  0.502589  0.298924  1
  P  P77  1  0.768213  0.570245  0.316936  1
  P  P78  1  0.214171  0.938507  0.308354  1
  P  P79  1  0.891369  0.568723  0.369644  1
  P  P80  1  0.643191  0.015715  0.367697  1
  P  P81  1  0.867510  0.635498  0.338709  1
  P  P82  1  0.833822  0.393788  0.366858  1
  P  P83  1  0.581084  0.393290  0.368496  1
  P  P84  1  0.037374  0.505826  0.348614  1
  P  P85  1  0.257843  0.077353  0.386714  1
  P  P86  1  0.510483  0.070259  0.401637  1
  P  P87  1  0.095729  0.694496  0.411920  1
  P  P88  1  0.787708  0.519537  0.407328  1
  P  P89  1  0.285950  0.520055  0.407435  1
  P  P90  1  0.824185  0.084634  0.443294  1
  P  P91  1  0.555898  0.467609  0.496570  1
  P  P92  1  0.594406  0.695381  0.412266  1
  P  P93  1  0.813844  0.451448  0.438274  1
  P  P94  1  0.062883  0.453699  0.438362  1
  P  P95  1  0.413256  0.515792  0.459277  1
  P  P96  1  0.095784  0.959432  0.406385  1
  P  P97  1  0.234322  0.193481  0.439349  1
  P  P98  1  0.979754  0.898965  0.388364  1
  P  P99  1  0.746689  0.193746  0.438367  1
  P  P100  1  0.977667  0.391310  0.416214  1
  P  P101  1  0.913210  0.516252  0.459560  1
  P  P102  1  0.237806  0.647463  0.449077  1
  P  P103  1  0.577678  0.076629  0.458739  1
  P  P104  1  0.709607  0.021853  0.424735  1
  P  P105  1  0.192072  0.138711  0.477422  1
  P  P106  1  0.757334  0.078410  0.386250  1
  P  P107  1  0.994310  0.632333  0.390575  1
  P  P108  1  0.806844  0.466501  0.496632  1
  P  P109  1  0.844442  0.694467  0.409368  1
  P  P110  1  0.244785  0.632541  0.390729  1
  P  P111  1  0.053131  0.904723  0.444772  1
  P  P112  1  0.344923  0.695053  0.411916  1
  P  P113  1  0.029422  0.019961  0.497627  1
  P  P114  1  0.347577  0.950972  0.421737  1
  P  P115  1  0.537564  0.519720  0.407676  1
  P  P116  1  0.137477  0.583997  0.428072  1
  P  P117  1  0.541872  0.904586  0.444946  1
  P  P118  1  0.625624  0.132855  0.420322  1
  P  P119  1  0.306359  0.466409  0.496469  1
  P  P120  1  0.563656  0.451567  0.438974  1
  P  P121  1  0.739080  0.647775  0.448883  1
  P  P122  1  0.163665  0.516209  0.459496  1
  P  P123  1  0.529925  0.019956  0.497271  1
  P  P124  1  0.438550  0.147163  0.461641  1
  P  P125  1  0.637873  0.583396  0.428125  1
  P  P126  1  0.077694  0.075968  0.458868  1
  P  P127  1  0.343391  0.708922  0.469766  1
  P  P128  1  0.987103  0.647878  0.448699  1
  P  P129  1  0.209939  0.021752  0.424905  1
  P  P130  1  0.915207  0.957155  0.479085  1
  P  P131  1  0.325470  0.084384  0.443545  1
  P  P132  1  0.764052  0.580461  0.480285  1
  P  P133  1  0.486621  0.898687  0.386962  1
  P  P134  1  0.776951  0.027949  0.481728  1
  P  P135  1  0.127191  0.131493  0.420183  1
  P  P136  1  0.743344  0.631546  0.391061  1
  P  P137  1  0.308793  0.199346  0.496154  1
  P  P138  1  0.704830  0.404415  0.476864  1
  P  P139  1  0.014027  0.580448  0.480267  1
  P  P140  1  0.989122  0.200607  0.422059  1
  P  P141  1  0.692187  0.139445  0.477215  1
  P  P142  1  0.161066  0.966502  0.463535  1
  P  P143  1  0.373066  0.140837  0.405278  1
  P  P144  1  0.661897  0.965519  0.463258  1
  P  P145  1  0.414395  0.957971  0.479206  1
  P  P146  1  0.056554  0.466480  0.496580  1
  P  P147  1  0.955600  0.404059  0.474612  1
  P  P148  1  0.263950  0.580001  0.480199  1
  P  P149  1  0.962091  0.013572  0.440422  1
  P  P150  1  0.299525  0.897385  0.461393  1
  P  P151  1  0.806207  0.200030  0.495860  1
  P  P152  1  0.940882  0.146913  0.461668  1
  P  P153  1  0.010444  0.069402  0.401673  1
  P  P154  1  0.887841  0.583690  0.428188  1
  P  P155  1  0.873433  0.140069  0.404401  1
  P  P156  1  0.313146  0.451551  0.438059  1
  P  P157  1  0.462826  0.013654  0.440260  1
  P  P158  1  0.595291  0.959418  0.406392  1
  P  P159  1  0.495088  0.633043  0.390447  1
  P  P160  1  0.036580  0.520433  0.407042  1
  P  P161  1  0.387841  0.583754  0.427976  1
  P  P162  1  0.848892  0.951190  0.422384  1
  P  P163  1  0.514676  0.579802  0.480269  1
  P  P164  1  0.276584  0.028364  0.482123  1
  P  P165  1  0.489580  0.646978  0.448898  1
  P  P166  1  0.454349  0.404393  0.476467  1
  P  P167  1  0.203272  0.404507  0.473998  1
  P  P168  1  0.664429  0.515804  0.459442  1
  P  P169  1  0.891905  0.090877  0.500092  1
  P  P170  1  0.144375  0.082889  0.515990  1
  P  P171  1  0.718055  0.706331  0.523720  1
  P  P172  1  0.406651  0.531037  0.517449  1
  P  P173  1  0.907300  0.530390  0.517452  1
  P  P174  1  0.458501  0.097185  0.557458  1
  P  P175  1  0.177983  0.479293  0.606657  1
  P  P176  1  0.216497  0.706423  0.520854  1
  P  P177  1  0.431747  0.463860  0.548820  1
  P  P178  1  0.683521  0.463375  0.548642  1
  P  P179  1  0.033486  0.527148  0.569531  1
  P  P180  1  0.729254  0.972127  0.520296  1
  P  P181  1  0.868196  0.206115  0.552946  1
  P  P182  1  0.612534  0.911492  0.501564  1
  P  P183  1  0.379455  0.206252  0.552772  1
  P  P184  1  0.577935  0.401917  0.527952  1
  P  P185  1  0.533486  0.527084  0.569743  1
  P  P186  1  0.858444  0.657139  0.559356  1
  P  P187  1  0.211720  0.088985  0.572983  1
  P  P188  1  0.343649  0.034210  0.538979  1
  P  P189  1  0.825543  0.151406  0.591334  1
  P  P190  1  0.391401  0.090882  0.500447  1
  P  P191  1  0.614968  0.644430  0.501250  1
  P  P192  1  0.426239  0.477796  0.607271  1
  P  P193  1  0.466977  0.706446  0.521251  1
  P  P194  1  0.864773  0.644359  0.501138  1
  P  P195  1  0.687005  0.917357  0.558369  1
  P  P196  1  0.965726  0.706779  0.523106  1
  P  P197  1  0.663484  0.033486  0.611004  1
  P  P198  1  0.980445  0.963925  0.536051  1
  P  P199  1  0.157275  0.530377  0.517433  1
  P  P200  1  0.757662  0.594630  0.538222  1
  P  P201  1  0.174637  0.917093  0.559352  1
  P  P202  1  0.259430  0.145319  0.534460  1
  P  P203  1  0.927017  0.478505  0.607143  1
  P  P204  1  0.182247  0.463063  0.548835  1
  P  P205  1  0.357670  0.659271  0.558745  1
  P  P206  1  0.783850  0.526841  0.569646  1
  P  P207  1  0.163993  0.032428  0.611468  1
  P  P208  1  0.072434  0.159648  0.575334  1
  P  P209  1  0.256898  0.595034  0.538276  1
  P  P210  1  0.711388  0.089086  0.572813  1
  P  P211  1  0.943660  0.719528  0.581504  1
  P  P212  1  0.608181  0.659288  0.559659  1
  P  P213  1  0.843633  0.034870  0.538850  1
  P  P214  1  0.548261  0.970002  0.592440  1
  P  P215  1  0.959236  0.097266  0.557297  1
  P  P216  1  0.383763  0.591118  0.590042  1
  P  P217  1  0.115120  0.910809  0.501858  1
  P  P218  1  0.410844  0.040579  0.596081  1
  P  P219  1  0.760261  0.144336  0.534183  1
  P  P220  1  0.365429  0.643229  0.501148  1
  P  P221  1  0.941573  0.211873  0.609355  1
  P  P222  1  0.326921  0.415457  0.585452  1
  P  P223  1  0.635377  0.590783  0.590283  1
  P  P224  1  0.621802  0.213453  0.536325  1
  P  P225  1  0.326036  0.151420  0.591326  1
  P  P226  1  0.794136  0.979345  0.577536  1
  P  P227  1  0.006120  0.153683  0.518633  1
  P  P228  1  0.295703  0.977983  0.577397  1
  P  P229  1  0.047894  0.970769  0.593318  1
  P  P230  1  0.676542  0.478297  0.606989  1
  P  P231  1  0.576404  0.415785  0.585802  1
  P  P232  1  0.884747  0.590405  0.590677  1
  P  P233  1  0.595857  0.026455  0.554173  1
  P  P234  1  0.932205  0.910231  0.575660  1
  P  P235  1  0.434706  0.212151  0.610757  1
  P  P236  1  0.573750  0.159866  0.575981  1
  P  P237  1  0.644743  0.082475  0.515596  1
  P  P238  1  0.508071  0.595046  0.538441  1
  P  P239  1  0.506932  0.152867  0.518513  1
  P  P240  1  0.934224  0.462960  0.549019  1
  P  P241  1  0.097142  0.026204  0.554424  1
  P  P242  1  0.229140  0.971393  0.520503  1
  P  P243  1  0.114483  0.644337  0.501087  1
  P  P244  1  0.657377  0.530837  0.517520  1
  P  P245  1  0.008117  0.594586  0.538158  1
  P  P246  1  0.482777  0.963676  0.536077  1
  P  P247  1  0.133619  0.591301  0.590390  1
  P  P248  1  0.910883  0.041436  0.596045  1
  P  P249  1  0.107483  0.659390  0.559444  1
  P  P250  1  0.076885  0.416371  0.588351  1
  P  P251  1  0.825598  0.416342  0.585798  1
  P  P252  1  0.283454  0.527442  0.569593  1
  P  P253  1  0.526127  0.103667  0.614480  1
  P  P254  1  0.778789  0.095917  0.630114  1
  P  P255  1  0.340243  0.717548  0.629223  1
  P  P256  1  0.029957  0.542115  0.628074  1
  P  P257  1  0.527990  0.542401  0.627896  1
  P  P258  1  0.092970  0.109575  0.671782  1
  P  P259  1  0.795082  0.491539  0.716993  1
  P  P260  1  0.833808  0.717272  0.634983  1
  P  P261  1  0.053817  0.475341  0.659010  1
  P  P262  1  0.302937  0.478129  0.659793  1
  P  P263  1  0.651904  0.540151  0.680619  1
  P  P264  1  0.363928  0.984315  0.634614  1
  P  P265  1  0.505159  0.218569  0.667216  1
  P  P266  1  0.244758  0.924240  0.615913  1
  P  P267  1  0.011944  0.219508  0.665193  1
  P  P268  1  0.218321  0.414845  0.638488  1
  P  P269  1  0.153114  0.540593  0.680782  1
  P  P270  1  0.495884  0.674329  0.665661  1
  P  P271  1  0.847645  0.102369  0.687125  1
  P  P272  1  0.977424  0.047209  0.653177  1
  P  P273  1  0.460038  0.163593  0.704899  1
  P  P274  1  0.025904  0.103759  0.614490  1
  P  P275  1  0.234661  0.655035  0.610784  1
  P  P276  1  0.046843  0.491104  0.716750  1
  P  P277  1  0.087505  0.717050  0.630860  1
  P  P278  1  0.485076  0.653474  0.610181  1
  P  P279  1  0.315304  0.930864  0.672633  1
  P  P280  1  0.587890  0.717832  0.620587  1
  P  P281  1  0.293002  0.046040  0.723897  1
  P  P282  1  0.615074  0.978497  0.648668  1
  P  P283  1  0.778402  0.541842  0.628066  1
  P  P284  1  0.382743  0.607175  0.648263  1
  P  P285  1  0.808747  0.930903  0.672338  1
  P  P286  1  0.893938  0.157987  0.648397  1
  P  P287  1  0.544649  0.490942  0.716689  1
  P  P288  1  0.802169  0.475763  0.659457  1
  P  P289  1  0.993450  0.669476  0.669815  1
  P  P290  1  0.403225  0.541847  0.681037  1
  P  P291  1  0.793753  0.046231  0.723233  1
  P  P292  1  0.707156  0.172331  0.689364  1
  P  P293  1  0.883953  0.605012  0.649104  1
  P  P294  1  0.346774  0.100862  0.687293  1
  P  P295  1  0.630584  0.736935  0.673247  1
  P  P296  1  0.243940  0.671010  0.668102  1
  P  P297  1  0.477352  0.047862  0.653189  1
  P  P298  1  0.181706  0.984036  0.706219  1
  P  P299  1  0.595444  0.109814  0.672107  1
  P  P300  1  1.003699  0.603550  0.700559  1
  P  P301  1  0.745879  0.923563  0.615840  1
  P  P302  1  0.041690  0.053057  0.709645  1
  P  P303  1  0.394739  0.156362  0.648739  1
  P  P304  1  0.984885  0.654329  0.612186  1
  P  P305  1  0.571012  0.223096  0.722342  1
  P  P306  1  0.944094  0.429581  0.696794  1
  P  P307  1  0.253398  0.605618  0.699988  1
  P  P308  1  0.257714  0.225906  0.654105  1
  P  P309  1  0.961421  0.166009  0.704196  1
  P  P310  1  0.428786  0.991768  0.691749  1
  P  P311  1  0.639920  0.166241  0.632889  1
  P  P312  1  0.928151  0.991127  0.691617  1
  P  P313  1  0.679452  0.983710  0.705526  1
  P  P314  1  0.296474  0.491291  0.717023  1
  P  P315  1  0.194990  0.428847  0.696378  1
  P  P316  1  0.503989  0.608249  0.698794  1
  P  P317  1  0.230115  0.038762  0.668151  1
  P  P318  1  0.564954  0.922833  0.682580  1
  P  P319  1  0.084501  0.226932  0.718441  1
  P  P320  1  0.207801  0.170243  0.689859  1
  P  P321  1  0.278136  0.095123  0.630021  1
  P  P322  1  0.133538  0.606458  0.648746  1
  P  P323  1  0.142122  0.165857  0.632416  1
  P  P324  1  0.552588  0.476801  0.659409  1
  P  P325  1  0.731377  0.039368  0.667967  1
  P  P326  1  0.863381  0.984589  0.634273  1
  P  P327  1  0.738133  0.654105  0.611786  1
  P  P328  1  0.279545  0.543028  0.627931  1
  P  P329  1  0.632831  0.605908  0.648551  1
  P  P330  1  0.114466  0.976515  0.650414  1
  P  P331  1  0.755625  0.601184  0.701299  1
  P  P332  1  0.542643  0.053569  0.709875  1
  P  P333  1  0.743510  0.666760  0.670563  1
  P  P334  1  0.693627  0.429499  0.696861  1
  P  P335  1  0.443066  0.428998  0.695103  1
  P  P336  1  0.904011  0.538864  0.680402  1
