# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   51.21836324
_cell_length_b   32.11271040
_cell_length_c   51.39130121
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   71.16997873
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P432
_cell_volume   80002.5516612
_cell_formula_units_Z   432
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  0.139847  0.468447  0.323271  1
  P  P2  1  0.124749  0.029923  0.489938  1
  P  P3  1  0.473181  0.468447  0.323271  1
  P  P4  1  0.132298  0.249185  0.406604  1
  P  P5  1  0.458083  0.029923  0.489938  1
  P  P6  1  0.806514  0.468447  0.323271  1
  P  P7  1  0.465632  0.249185  0.406604  1
  P  P8  1  0.791416  0.029923  0.489938  1
  P  P9  1  0.798965  0.249185  0.406604  1
  P  P10  1  0.129338  0.562942  0.427258  1
  P  P11  1  0.136887  0.782203  0.343925  1
  P  P12  1  0.462671  0.562942  0.427258  1
  P  P13  1  0.144436  1.001465  0.260592  1
  P  P14  1  0.470220  0.782203  0.343925  1
  P  P15  1  0.796005  0.562942  0.427258  1
  P  P16  1  0.477770  1.001465  0.260592  1
  P  P17  1  0.803554  0.782203  0.343925  1
  P  P18  1  0.811103  1.001465  0.260592  1
  P  P19  1  0.124516  0.385529  0.305877  1
  P  P20  1  0.109418  0.947005  0.472544  1
  P  P21  1  0.457850  0.385529  0.305877  1
  P  P22  1  0.116967  0.166267  0.389210  1
  P  P23  1  0.442752  0.947005  0.472544  1
  P  P24  1  0.791183  0.385529  0.305877  1
  P  P25  1  0.450301  0.166267  0.389210  1
  P  P26  1  0.776085  0.947005  0.472544  1
  P  P27  1  0.783634  0.166267  0.389210  1
  P  P28  1  0.144669  0.645860  0.444652  1
  P  P29  1  0.152218  0.865122  0.361319  1
  P  P30  1  0.478002  0.645860  0.444652  1
  P  P31  1  0.159767  0.084383  0.277986  1
  P  P32  1  0.485551  0.865122  0.361319  1
  P  P33  1  0.811336  0.645860  0.444652  1
  P  P34  1  0.493100  0.084383  0.277986  1
  P  P35  1  0.818885  0.865122  0.361319  1
  P  P36  1  0.826434  0.084383  0.277986  1
  P  P37  1  0.186626  0.380814  0.308866  1
  P  P38  1  0.171528  0.942291  0.475532  1
  P  P39  1  0.519960  0.380814  0.308866  1
  P  P40  1  0.179077  0.161553  0.392199  1
  P  P41  1  0.504862  0.942291  0.475532  1
  P  P42  1  0.853293  0.380814  0.308866  1
  P  P43  1  0.512411  0.161553  0.392199  1
  P  P44  1  0.838195  0.942291  0.475532  1
  P  P45  1  0.845744  0.161553  0.392199  1
  P  P46  1  0.082559  0.650574  0.441663  1
  P  P47  1  0.090108  0.869836  0.358330  1
  P  P48  1  0.415892  0.650574  0.441663  1
  P  P49  1  0.097657  0.089098  0.274997  1
  P  P50  1  0.423441  0.869836  0.358330  1
  P  P51  1  0.749226  0.650574  0.441663  1
  P  P52  1  0.430990  0.089098  0.274997  1
  P  P53  1  0.756775  0.869836  0.358330  1
  P  P54  1  0.764324  0.089098  0.274997  1
  P  P55  1  0.148257  0.436767  0.265162  1
  P  P56  1  0.133159  0.998243  0.431829  1
  P  P57  1  0.481591  0.436767  0.265162  1
  P  P58  1  0.140708  0.217505  0.348496  1
  P  P59  1  0.466493  0.998243  0.431829  1
  P  P60  1  0.814924  0.436767  0.265162  1
  P  P61  1  0.474042  0.217505  0.348496  1
  P  P62  1  0.799826  0.998243  0.431829  1
  P  P63  1  0.807375  0.217505  0.348496  1
  P  P64  1  0.120928  0.594622  0.485367  1
  P  P65  1  0.128477  0.813883  0.402033  1
  P  P66  1  0.454261  0.594622  0.485367  1
  P  P67  1  0.136026  0.033145  0.318700  1
  P  P68  1  0.461810  0.813883  0.402033  1
  P  P69  1  0.787595  0.594622  0.485367  1
  P  P70  1  0.469359  0.033145  0.318700  1
  P  P71  1  0.795144  0.813883  0.402033  1
  P  P72  1  0.802693  0.033145  0.318700  1
  P  P73  1  0.254830  0.364204  0.411057  1
  P  P74  1  0.262379  0.583466  0.327724  1
  P  P75  1  0.588163  0.364204  0.411057  1
  P  P76  1  0.247281  0.144943  0.494391  1
  P  P77  1  0.595712  0.583466  0.327724  1
  P  P78  1  0.921497  0.364204  0.411057  1
  P  P79  1  0.580614  0.144943  0.494391  1
  P  P80  1  0.929046  0.583466  0.327724  1
  P  P81  1  0.913948  0.144943  0.494391  1
  P  P82  1  0.014355  0.667184  0.339472  1
  P  P83  1  0.022538  0.887017  0.256177  1
  P  P84  1  0.347689  0.667184  0.339472  1
  P  P85  1  0.006806  0.447922  0.422805  1
  P  P86  1  0.355871  0.887017  0.256177  1
  P  P87  1  0.681022  0.667184  0.339472  1
  P  P88  1  0.340140  0.447922  0.422805  1
  P  P89  1  0.689205  0.887017  0.256177  1
  P  P90  1  0.673473  0.447922  0.422805  1
  P  P91  1  0.191928  0.374660  0.415877  1
  P  P92  1  0.199477  0.593922  0.332544  1
  P  P93  1  0.525261  0.374660  0.415877  1
  P  P94  1  0.184379  0.155398  0.499211  1
  P  P95  1  0.532810  0.593922  0.332544  1
  P  P96  1  0.858595  0.374660  0.415877  1
  P  P97  1  0.517712  0.155398  0.499211  1
  P  P98  1  0.866144  0.593922  0.332544  1
  P  P99  1  0.851046  0.155398  0.499211  1
  P  P100  1  0.077258  0.656729  0.334652  1
  P  P101  1  0.083981  0.876812  0.251451  1
  P  P102  1  0.410591  0.656729  0.334652  1
  P  P103  1  0.069709  0.437467  0.417985  1
  P  P104  1  0.417314  0.876812  0.251451  1
  P  P105  1  0.743924  0.656729  0.334652  1
  P  P106  1  0.403042  0.437467  0.417985  1
  P  P107  1  0.750648  0.876812  0.251451  1
  P  P108  1  0.736375  0.437467  0.417985  1
  P  P109  1  0.234366  0.283935  0.399245  1
  P  P110  1  0.241915  0.503197  0.315911  1
  P  P111  1  0.567700  0.283935  0.399245  1
  P  P112  1  0.226817  0.064673  0.482578  1
  P  P113  1  0.575249  0.503197  0.315911  1
  P  P114  1  0.901033  0.283935  0.399245  1
  P  P115  1  0.560151  0.064673  0.482578  1
  P  P116  1  0.908582  0.503197  0.315911  1
  P  P117  1  0.893484  0.064673  0.482578  1
  P  P118  1  0.034819  0.747454  0.351285  1
  P  P119  1  0.042535  0.965406  0.267761  1
  P  P120  1  0.368152  0.747454  0.351285  1
  P  P121  1  0.027270  0.528192  0.434618  1
  P  P122  1  0.375868  0.965406  0.267761  1
  P  P123  1  0.701486  0.747454  0.351285  1
  P  P124  1  0.360603  0.528192  0.434618  1
  P  P125  1  0.709201  0.965406  0.267761  1
  P  P126  1  0.693937  0.528192  0.434618  1
  P  P127  1  0.241713  0.536918  0.373273  1
  P  P128  1  0.249237  0.756262  0.289920  1
  P  P129  1  0.575046  0.536918  0.373273  1
  P  P130  1  0.234164  0.317656  0.456606  1
  P  P131  1  0.582570  0.756262  0.289920  1
  P  P132  1  0.908380  0.536918  0.373273  1
  P  P133  1  0.567497  0.317656  0.456606  1
  P  P134  1  0.915903  0.756262  0.289920  1
  P  P135  1  0.900831  0.317656  0.456606  1
  P  P136  1  0.027472  0.494470  0.377257  1
  P  P137  1  0.035021  0.713732  0.293923  1
  P  P138  1  0.360806  0.494470  0.377257  1
  P  P139  1  0.019923  0.275209  0.460590  1
  P  P140  1  0.368355  0.713732  0.293923  1
  P  P141  1  0.694139  0.494470  0.377257  1
  P  P142  1  0.353257  0.275209  0.460590  1
  P  P143  1  0.701688  0.713732  0.293923  1
  P  P144  1  0.686590  0.275209  0.460590  1
  P  P145  1  0.021982  0.833441  0.457517  1
  P  P146  1  0.029531  0.052703  0.374183  1
  P  P147  1  0.355315  0.833441  0.457517  1
  P  P148  1  0.037080  0.271965  0.290850  1
  P  P149  1  0.362864  0.052703  0.374183  1
  P  P150  1  0.688648  0.833441  0.457517  1
  P  P151  1  0.370413  0.271965  0.290850  1
  P  P152  1  0.696197  0.052703  0.374183  1
  P  P153  1  0.703746  0.271965  0.290850  1
  P  P154  1  0.249198  0.196184  0.292345  1
  P  P155  1  0.232106  0.759424  0.459679  1
  P  P156  1  0.582532  0.196184  0.292345  1
  P  P157  1  0.239655  0.978685  0.376346  1
  P  P158  1  0.565439  0.759424  0.459679  1
  P  P159  1  0.915865  0.196184  0.292345  1
  P  P160  1  0.572988  0.978685  0.376346  1
  P  P161  1  0.898773  0.759424  0.459679  1
  P  P162  1  0.906322  0.978685  0.376346  1
  P  P163  1  0.021564  0.461600  0.257139  1
  P  P164  1  0.005939  0.020116  0.423733  1
  P  P165  1  0.354898  0.461600  0.257139  1
  P  P166  1  0.013488  0.239378  0.340399  1
  P  P167  1  0.339273  0.020116  0.423733  1
  P  P168  1  0.688231  0.461600  0.257139  1
  P  P169  1  0.346822  0.239378  0.340399  1
  P  P170  1  0.672606  0.020116  0.423733  1
  P  P171  1  0.680155  0.239378  0.340399  1
  P  P172  1  0.248148  0.572749  0.493463  1
  P  P173  1  0.255697  0.792011  0.410130  1
  P  P174  1  0.581482  0.572749  0.493463  1
  P  P175  1  0.263246  0.011272  0.326797  1
  P  P176  1  0.589031  0.792011  0.410130  1
  P  P177  1  0.914815  0.572749  0.493463  1
  P  P178  1  0.596580  0.011272  0.326797  1
  P  P179  1  0.922364  0.792011  0.410130  1
  P  P180  1  0.929913  0.011272  0.326797  1
  P  P181  1  0.962708  0.886095  0.477865  1
  P  P182  1  0.970257  0.105356  0.394532  1
  P  P183  1  0.296042  0.886095  0.477865  1
  P  P184  1  0.977806  0.324618  0.311199  1
  P  P185  1  0.303591  0.105356  0.394532  1
  P  P186  1  0.629375  0.886095  0.477865  1
  P  P187  1  0.311140  0.324618  0.311199  1
  P  P188  1  0.636924  0.105356  0.394532  1
  P  P189  1  0.644473  0.324618  0.311199  1
  P  P190  1  0.304415  0.147133  0.273309  1
  P  P191  1  0.291379  0.706770  0.439330  1
  P  P192  1  0.637748  0.147133  0.273309  1
  P  P193  1  0.298928  0.926032  0.355997  1
  P  P194  1  0.624712  0.706770  0.439330  1
  P  P195  1  0.971082  0.147133  0.273309  1
  P  P196  1  0.632261  0.926032  0.355997  1
  P  P197  1  0.958046  0.706770  0.439330  1
  P  P198  1  0.965595  0.926032  0.355997  1
  P  P199  1  0.036934  0.541709  0.259593  1
  P  P200  1  0.022431  0.106070  0.426355  1
  P  P201  1  0.370268  0.541709  0.259593  1
  P  P202  1  0.029980  0.325332  0.343021  1
  P  P203  1  0.355764  0.106070  0.426355  1
  P  P204  1  0.703601  0.541709  0.259593  1
  P  P205  1  0.363313  0.325332  0.343021  1
  P  P206  1  0.689098  0.106070  0.426355  1
  P  P207  1  0.696647  0.325332  0.343021  1
  P  P208  1  0.231656  0.486795  0.490841  1
  P  P209  1  0.239205  0.706057  0.407508  1
  P  P210  1  0.564990  0.486795  0.490841  1
  P  P211  1  0.246754  0.925319  0.324175  1
  P  P212  1  0.572539  0.706057  0.407508  1
  P  P213  1  0.898323  0.486795  0.490841  1
  P  P214  1  0.580088  0.925319  0.324175  1
  P  P215  1  0.905872  0.706057  0.407508  1
  P  P216  1  0.913421  0.925319  0.324175  1
  P  P217  1  0.117200  0.810662  0.573271  1
  P  P218  1  0.102102  0.372138  0.739938  1
  P  P219  1  0.450534  0.810662  0.573271  1
  P  P220  1  0.109651  0.591400  0.656604  1
  P  P221  1  0.435436  0.372138  0.739938  1
  P  P222  1  0.783867  0.810662  0.573271  1
  P  P223  1  0.442985  0.591400  0.656604  1
  P  P224  1  0.768769  0.372138  0.739938  1
  P  P225  1  0.776318  0.591400  0.656604  1
  P  P226  1  0.106691  0.905156  0.677258  1
  P  P227  1  0.114240  0.124418  0.593925  1
  P  P228  1  0.440024  0.905156  0.677258  1
  P  P229  1  0.121789  0.343680  0.510592  1
  P  P230  1  0.447573  0.124418  0.593925  1
  P  P231  1  0.773358  0.905156  0.677258  1
  P  P232  1  0.455122  0.343680  0.510592  1
  P  P233  1  0.780907  0.124418  0.593925  1
  P  P234  1  0.788456  0.343680  0.510592  1
  P  P235  1  0.101869  0.727743  0.555877  1
  P  P236  1  0.086771  0.289220  0.722544  1
  P  P237  1  0.435203  0.727743  0.555877  1
  P  P238  1  0.094320  0.508482  0.639210  1
  P  P239  1  0.420105  0.289220  0.722544  1
  P  P240  1  0.768536  0.727743  0.555877  1
  P  P241  1  0.427654  0.508482  0.639210  1
  P  P242  1  0.753438  0.289220  0.722544  1
  P  P243  1  0.760987  0.508482  0.639210  1
  P  P244  1  0.122022  0.988075  0.694652  1
  P  P245  1  0.129571  0.207336  0.611319  1
  P  P246  1  0.455355  0.988075  0.694652  1
  P  P247  1  0.137120  0.426598  0.527986  1
  P  P248  1  0.462904  0.207336  0.611319  1
  P  P249  1  0.788689  0.988075  0.694652  1
  P  P250  1  0.470453  0.426598  0.527986  1
  P  P251  1  0.796238  0.207336  0.611319  1
  P  P252  1  0.803787  0.426598  0.527986  1
  P  P253  1  0.163979  0.723029  0.558866  1
  P  P254  1  0.148881  0.284505  0.725532  1
  P  P255  1  0.497313  0.723029  0.558866  1
  P  P256  1  0.156430  0.503767  0.642199  1
  P  P257  1  0.482215  0.284505  0.725532  1
  P  P258  1  0.830646  0.723029  0.558866  1
  P  P259  1  0.489764  0.503767  0.642199  1
  P  P260  1  0.815548  0.284505  0.725532  1
  P  P261  1  0.823097  0.503767  0.642199  1
  P  P262  1  0.059912  0.992789  0.691663  1
  P  P263  1  0.067461  0.212051  0.608330  1
  P  P264  1  0.393245  0.992789  0.691663  1
  P  P265  1  0.075010  0.431312  0.524997  1
  P  P266  1  0.400794  0.212051  0.608330  1
  P  P267  1  0.726579  0.992789  0.691663  1
  P  P268  1  0.408343  0.431312  0.524997  1
  P  P269  1  0.734128  0.212051  0.608330  1
  P  P270  1  0.741677  0.431312  0.524997  1
  P  P271  1  0.125610  0.778982  0.515162  1
  P  P272  1  0.110512  0.340458  0.681829  1
  P  P273  1  0.458944  0.778982  0.515162  1
  P  P274  1  0.118061  0.559720  0.598496  1
  P  P275  1  0.443846  0.340458  0.681829  1
  P  P276  1  0.792277  0.778982  0.515162  1
  P  P277  1  0.451395  0.559720  0.598496  1
  P  P278  1  0.777179  0.340458  0.681829  1
  P  P279  1  0.784728  0.559720  0.598496  1
  P  P280  1  0.098281  0.936836  0.735367  1
  P  P281  1  0.105830  0.156098  0.652033  1
  P  P282  1  0.431614  0.936836  0.735367  1
  P  P283  1  0.113379  0.375360  0.568700  1
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