# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   34.12567664
_cell_length_b   50.22259863
_cell_length_c   54.39816634
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   92.10200116
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P432
_cell_volume   93169.2035624
_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  0.461860  0.314418  0.374329  1
  P  P2  1  0.488397  0.658456  0.421948  1
  P  P3  1  0.961860  0.314418  0.374329  1
  P  P4  1  0.435059  0.971129  0.326450  1
  P  P5  1  0.988397  0.658456  0.421948  1
  P  P6  1  0.935059  0.971129  0.326450  1
  P  P7  1  0.468346  0.195186  0.389065  1
  P  P8  1  0.415271  0.507110  0.293827  1
  P  P9  1  0.968346  0.195186  0.389065  1
  P  P10  1  0.441808  0.851148  0.341446  1
  P  P11  1  0.915271  0.507110  0.293827  1
  P  P12  1  0.941808  0.851148  0.341446  1
  P  P13  1  0.415530  0.348942  0.336887  1
  P  P14  1  0.442067  0.692980  0.384506  1
  P  P15  1  0.915530  0.348942  0.336887  1
  P  P16  1  0.389910  0.004853  0.289821  1
  P  P17  1  0.942067  0.692980  0.384506  1
  P  P18  1  0.889910  0.004853  0.289821  1
  P  P19  1  0.514676  0.160662  0.426507  1
  P  P20  1  0.461601  0.472586  0.331269  1
  P  P21  1  0.014676  0.160662  0.426507  1
  P  P22  1  0.488139  0.816624  0.378888  1
  P  P23  1  0.961601  0.472586  0.331269  1
  P  P24  1  0.988139  0.816624  0.378888  1
  P  P25  1  0.507217  0.347099  0.333421  1
  P  P26  1  0.533755  0.691137  0.381040  1
  P  P27  1  0.007217  0.347099  0.333421  1
  P  P28  1  0.560292  0.035175  0.428659  1
  P  P29  1  0.033755  0.691137  0.381040  1
  P  P30  1  0.060292  0.035175  0.428659  1
  P  P31  1  0.343610  0.130393  0.287083  1
  P  P32  1  0.369914  0.474429  0.334735  1
  P  P33  1  0.843610  0.130393  0.287083  1
  P  P34  1  0.396451  0.818467  0.382354  1
  P  P35  1  0.869914  0.474429  0.334735  1
  P  P36  1  0.896451  0.818467  0.382354  1
  P  P37  1  0.468230  0.376850  0.377335  1
  P  P38  1  0.494767  0.720888  0.424954  1
  P  P39  1  0.968230  0.376850  0.377335  1
  P  P40  1  0.441273  0.032115  0.329391  1
  P  P41  1  0.994767  0.720888  0.424954  1
  P  P42  1  0.941273  0.032115  0.329391  1
  P  P43  1  0.461975  0.132753  0.386059  1
  P  P44  1  0.408901  0.444677  0.290820  1
  P  P45  1  0.961975  0.132753  0.386059  1
  P  P46  1  0.435438  0.788715  0.338439  1
  P  P47  1  0.908901  0.444677  0.290820  1
  P  P48  1  0.935438  0.788715  0.338439  1
  P  P49  1  0.596300  0.253174  0.290364  1
  P  P50  1  0.625965  0.597442  0.337889  1
  P  P51  1  0.096300  0.253174  0.290364  1
  P  P52  1  0.652502  0.941480  0.385508  1
  P  P53  1  0.125965  0.597442  0.337889  1
  P  P54  1  0.152502  0.941480  0.385508  1
  P  P55  1  0.251166  0.224086  0.330267  1
  P  P56  1  0.277703  0.568124  0.377886  1
  P  P57  1  0.751166  0.224086  0.330267  1
  P  P58  1  0.304241  0.912162  0.425505  1
  P  P59  1  0.777703  0.568124  0.377886  1
  P  P60  1  0.804241  0.912162  0.425505  1
  P  P61  1  0.510928  0.246772  0.293954  1
  P  P62  1  0.534362  0.590575  0.341727  1
  P  P63  1  0.010928  0.246772  0.293954  1
  P  P64  1  0.560899  0.934613  0.389346  1
  P  P65  1  0.034362  0.590575  0.341727  1
  P  P66  1  0.060899  0.934613  0.389346  1
  P  P67  1  0.342769  0.230953  0.326429  1
  P  P68  1  0.369307  0.574991  0.374048  1
  P  P69  1  0.842769  0.230953  0.326429  1
  P  P70  1  0.395844  0.919029  0.421667  1
  P  P71  1  0.869307  0.574991  0.374048  1
  P  P72  1  0.895844  0.919029  0.421667  1
  P  P73  1  0.625491  0.314130  0.395191  1
  P  P74  1  0.572416  0.626054  0.299953  1
  P  P75  1  0.125491  0.314130  0.395191  1
  P  P76  1  0.598953  0.970092  0.347572  1
  P  P77  1  0.072416  0.626054  0.299953  1
  P  P78  1  0.098953  0.970092  0.347572  1
  P  P79  1  0.304715  0.195474  0.368203  1
  P  P80  1  0.331252  0.539512  0.415822  1
  P  P81  1  0.804715  0.195474  0.368203  1
  P  P82  1  0.277941  0.853552  0.320608  1
  P  P83  1  0.831252  0.539512  0.415822  1
  P  P84  1  0.777941  0.853552  0.320608  1
  P  P85  1  0.632074  0.251972  0.393502  1
  P  P86  1  0.579000  0.563896  0.298264  1
  P  P87  1  0.132074  0.251972  0.393502  1
  P  P88  1  0.605537  0.907934  0.345883  1
  P  P89  1  0.079000  0.563896  0.298264  1
  P  P90  1  0.105537  0.907934  0.345883  1
  P  P91  1  0.298131  0.257632  0.369892  1
  P  P92  1  0.324669  0.601670  0.417511  1
  P  P93  1  0.798131  0.257632  0.369892  1
  P  P94  1  0.271807  0.911483  0.322188  1
  P  P95  1  0.824669  0.601670  0.417511  1
  P  P96  1  0.771807  0.911483  0.322188  1
  P  P97  1  0.331661  0.420003  0.425296  1
  P  P98  1  0.278586  0.731927  0.330058  1
  P  P99  1  0.831661  0.420003  0.425296  1
  P  P100  1  0.305123  0.075965  0.377677  1
  P  P101  1  0.778586  0.731927  0.330058  1
  P  P102  1  0.805123  0.075965  0.377677  1
  P  P103  1  0.598545  0.089600  0.338097  1
  P  P104  1  0.625082  0.433638  0.385717  1
  P  P105  1  0.098545  0.089600  0.338097  1
  P  P106  1  0.573686  0.747021  0.291562  1
  P  P107  1  0.125082  0.433638  0.385717  1
  P  P108  1  0.073686  0.747021  0.291562  1
  P  P109  1  0.284176  0.379619  0.391614  1
  P  P110  1  0.231102  0.691543  0.296376  1
  P  P111  1  0.784176  0.379619  0.391614  1
  P  P112  1  0.257639  0.035581  0.343995  1
  P  P113  1  0.731102  0.691543  0.296376  1
  P  P114  1  0.757639  0.035581  0.343995  1
  P  P115  1  0.646029  0.129985  0.371780  1
  P  P116  1  0.672567  0.474023  0.419399  1
  P  P117  1  0.146029  0.129985  0.371780  1
  P  P118  1  0.617879  0.784617  0.323029  1
  P  P119  1  0.172567  0.474023  0.419399  1
  P  P120  1  0.117879  0.784617  0.323029  1
  P  P121  1  0.180070  0.356090  0.302727  1
  P  P122  1  0.203953  0.701102  0.350704  1
  P  P123  1  0.680070  0.356090  0.302727  1
  P  P124  1  0.230490  0.045140  0.398323  1
  P  P125  1  0.703953  0.701102  0.350704  1
  P  P126  1  0.730490  0.045140  0.398323  1
  P  P127  1  0.673178  0.120425  0.317452  1
  P  P128  1  0.699715  0.464463  0.365071  1
  P  P129  1  0.173178  0.120425  0.317452  1
  P  P130  1  0.726253  0.808501  0.412690  1
  P  P131  1  0.199715  0.464463  0.365071  1
  P  P132  1  0.226253  0.808501  0.412690  1
  P  P133  1  0.251699  0.327564  0.293063  1
  P  P134  1  0.280824  0.670499  0.340372  1
  P  P135  1  0.751699  0.327564  0.293063  1
  P  P136  1  0.307361  0.014537  0.387991  1
  P  P137  1  0.780824  0.670499  0.340372  1
  P  P138  1  0.807361  0.014537  0.387991  1
  P  P139  1  0.596307  0.151028  0.327784  1
  P  P140  1  0.622844  0.495066  0.375403  1
  P  P141  1  0.096307  0.151028  0.327784  1
  P  P142  1  0.649382  0.839104  0.423022  1
  P  P143  1  0.122844  0.495066  0.375403  1
  P  P144  1  0.149382  0.839104  0.423022  1
  P  P145  1  0.541472  0.346532  0.517186  1
  P  P146  1  0.568009  0.690570  0.564805  1
  P  P147  1  0.041472  0.346532  0.517186  1
  P  P148  1  0.514935  1.002494  0.469567  1
  P  P149  1  0.068009  0.690570  0.564805  1
  P  P150  1  0.014935  1.002494  0.469567  1
  P  P151  1  0.547957  0.227300  0.531922  1
  P  P152  1  0.494883  0.539224  0.436684  1
  P  P153  1  0.047957  0.227300  0.531922  1
  P  P154  1  0.521420  0.883262  0.484303  1
  P  P155  1  0.994883  0.539224  0.436684  1
  P  P156  1  0.021420  0.883262  0.484303  1
  P  P157  1  0.495141  0.381056  0.479744  1
  P  P158  1  0.521679  0.725094  0.527363  1
  P  P159  1  0.995141  0.381056  0.479744  1
  P  P160  1  0.468604  0.037018  0.432125  1
  P  P161  1  0.021679  0.725094  0.527363  1
  P  P162  1  0.968604  0.037018  0.432125  1
  P  P163  1  0.594288  0.192776  0.569364  1
  P  P164  1  0.541213  0.504700  0.474126  1
  P  P165  1  0.094288  0.192776  0.569364  1
  P  P166  1  0.567751  0.848738  0.521745  1
  P  P167  1  0.041213  0.504700  0.474126  1
  P  P168  1  0.067751  0.848738  0.521745  1
  P  P169  1  0.586829  0.379213  0.476278  1
  P  P170  1  0.613367  0.723251  0.523897  1
  P  P171  1  0.086829  0.379213  0.476278  1
  P  P172  1  0.639904  0.067289  0.571516  1
  P  P173  1  0.113367  0.723251  0.523897  1
  P  P174  1  0.139904  0.067289  0.571516  1
  P  P175  1  0.422988  0.162505  0.429973  1
  P  P176  1  0.449525  0.506543  0.477592  1
  P  P177  1  0.922988  0.162505  0.429973  1
  P  P178  1  0.476063  0.850581  0.525212  1
  P  P179  1  0.949525  0.506543  0.477592  1
  P  P180  1  0.976063  0.850581  0.525212  1
  P  P181  1  0.547842  0.408964  0.520193  1
  P  P182  1  0.574379  0.753002  0.567812  1
  P  P183  1  0.047842  0.408964  0.520193  1
  P  P184  1  0.521305  0.064926  0.472574  1
  P  P185  1  0.074379  0.753002  0.567812  1
  P  P186  1  0.021305  0.064926  0.472574  1
  P  P187  1  0.541587  0.164867  0.528916  1
  P  P188  1  0.488513  0.476791  0.433678  1
  P  P189  1  0.041587  0.164867  0.528916  1
  P  P190  1  0.515050  0.820829  0.481297  1
  P  P191  1  0.988513  0.476791  0.433678  1
  P  P192  1  0.015050  0.820829  0.481297  1
  P  P193  1  0.679039  0.285518  0.433127  1
  P  P194  1  0.705577  0.629556  0.480746  1
  P  P195  1  0.179039  0.285518  0.433127  1
  P  P196  1  0.732114  0.973594  0.528365  1
  P  P197  1  0.205577  0.629556  0.480746  1
  P  P198  1  0.232114  0.973594  0.528365  1
  P  P199  1  0.330778  0.256200  0.473124  1
  P  P200  1  0.357315  0.600238  0.520743  1
  P  P201  1  0.830778  0.256200  0.473124  1
  P  P202  1  0.383853  0.944276  0.568362  1
  P  P203  1  0.857315  0.600238  0.520743  1
  P  P204  1  0.883853  0.944276  0.568362  1
  P  P205  1  0.587436  0.278651  0.436965  1
  P  P206  1  0.613973  0.622689  0.484584  1
  P  P207  1  0.087436  0.278651  0.436965  1
  P  P208  1  0.640511  0.966727  0.532203  1
  P  P209  1  0.113973  0.622689  0.484584  1
  P  P210  1  0.140511  0.966727  0.532203  1
  P  P211  1  0.422381  0.263067  0.469286  1
  P  P212  1  0.448919  0.607105  0.516905  1
  P  P213  1  0.922381  0.263067  0.469286  1
  P  P214  1  0.475456  0.951143  0.564524  1
  P  P215  1  0.948919  0.607105  0.516905  1
  P  P216  1  0.975456  0.951143  0.564524  1
  P  P217  1  0.705103  0.346244  0.538048  1
  P  P218  1  0.652028  0.658168  0.442810  1
  P  P219  1  0.205103  0.346244  0.538048  1
  P  P220  1  0.678565  1.002206  0.490429  1
  P  P221  1  0.152028  0.658168  0.442810  1
  P  P222  1  0.178565  1.002206  0.490429  1
  P  P223  1  0.384327  0.227588  0.511060  1
  P  P224  1  0.410864  0.571626  0.558679  1
  P  P225  1  0.884327  0.227588  0.511060  1
  P  P226  1  0.357789  0.883550  0.463441  1
  P  P227  1  0.910864  0.571626  0.558679  1
  P  P228  1  0.857789  0.883550  0.463441  1
  P  P229  1  0.711686  0.284086  0.536359  1
  P  P230  1  0.658611  0.596010  0.441121  1
  P  P231  1  0.211686  0.284086  0.536359  1
  P  P232  1  0.685149  0.940048  0.488740  1
  P  P233  1  0.158611  0.596010  0.441121  1
  P  P234  1  0.185149  0.940048  0.488740  1
  P  P235  1  0.377743  0.289746  0.512749  1
  P  P236  1  0.404280  0.633784  0.560368  1
  P  P237  1  0.877743  0.289746  0.512749  1
  P  P238  1  0.351206  0.945708  0.465130  1
  P  P239  1  0.904280  0.633784  0.560368  1
  P  P240  1  0.851206  0.945708  0.465130  1
  P  P241  1  0.411273  0.452117  0.568154  1
  P  P242  1  0.358198  0.764041  0.472916  1
  P  P243  1  0.911273  0.452117  0.568154  1
  P  P244  1  0.384735  0.108079  0.520535  1
  P  P245  1  0.858198  0.764041  0.472916  1
  P  P246  1  0.884735  0.108079  0.520535  1
  P  P247  1  0.678157  0.121714  0.480955  1
  P  P248  1  0.704694  0.465752  0.528574  1
  P  P249  1  0.178157  0.121714  0.480955  1
  P  P250  1  0.651619  0.777676  0.433336  1
  P  P251  1  0.204694  0.465752  0.528574  1
  P  P252  1  0.151619  0.777676  0.433336  1
  P  P253  1  0.363788  0.411733  0.534472  1
  P  P254  1  0.310713  0.723657  0.439233  1
  P  P255  1  0.863788  0.411733  0.534472  1
  P  P256  1  0.337251  0.067695  0.486852  1
  P  P257  1  0.810713  0.723657  0.439233  1
  P  P258  1  0.837251  0.067695  0.486852  1
  P  P259  1  0.725641  0.162099  0.514637  1
  P  P260  1  0.752179  0.506137  0.562256  1
  P  P261  1  0.225641  0.162099  0.514637  1
  P  P262  1  0.699104  0.818061  0.467018  1
  P  P263  1  0.252179  0.506137  0.562256  1
  P  P264  1  0.199104  0.818061  0.467018  1
  P  P265  1  0.257028  0.389178  0.445942  1
  P  P266  1  0.283565  0.733216  0.493561  1
  P  P267  1  0.757028  0.389178  0.445942  1
  P  P268  1  0.310102  0.077254  0.541180  1
  P  P269  1  0.783565  0.733216  0.493561  1
  P  P270  1  0.810102  0.077254  0.541180  1
  P  P271  1  0.752790  0.152539  0.460309  1
  P  P272  1  0.779327  0.496577  0.507928  1
  P  P273  1  0.252790  0.152539  0.460309  1
  P  P274  1  0.805864  0.840615  0.555547  1
  P  P275  1  0.279327  0.496577  0.507928  1
  P  P276  1  0.305864  0.840615  0.555547  1
  P  P277  1  0.333899  0.358575  0.435610  1
  P  P278  1  0.360436  0.702613  0.483229  1
  P  P279  1  0.833899  0.358575  0.435610  1
  P  P280  1  0.386973  0.046651  0.530848  1
  P  P281  1  0.860436  0.702613  0.483229  1
  P  P282  1  0.886973  0.046651  0.530848  1
  P  P283  1  0.675919  0.183142  0.470641  1
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