# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   27.45055496
_cell_length_b   52.38494355
_cell_length_c   56.92831993
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   77.72817333
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P432
_cell_volume   79992.1380074
_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  0.234957  0.296061  0.449449  1
  P  P2  1  0.705325  0.349230  0.282612  1
  P  P3  1  0.234957  0.962728  0.449449  1
  P  P4  1  0.705325  0.015897  0.282612  1
  P  P5  1  0.234957  0.629395  0.449449  1
  P  P6  1  0.469750  0.323020  0.366116  1
  P  P7  1  0.705325  0.682564  0.282612  1
  P  P8  1  0.469750  0.989686  0.366116  1
  P  P9  1  0.469750  0.656353  0.366116  1
  P  P10  1  0.183882  0.412345  0.468850  1
  P  P11  1  0.653468  0.466262  0.302184  1
  P  P12  1  0.183882  0.079011  0.468850  1
  P  P13  1  0.653468  0.132929  0.302184  1
  P  P14  1  0.183882  0.745678  0.468850  1
  P  P15  1  0.418675  0.439303  0.385517  1
  P  P16  1  0.653468  0.799595  0.302184  1
  P  P17  1  0.418675  0.105970  0.385517  1
  P  P18  1  0.418675  0.772637  0.385517  1
  P  P19  1  0.333586  0.258612  0.432467  1
  P  P20  1  0.801647  0.312654  0.265990  1
  P  P21  1  0.333586  0.925279  0.432467  1
  P  P22  1  0.801647  0.979320  0.265990  1
  P  P23  1  0.333586  0.591945  0.432467  1
  P  P24  1  0.568379  0.285571  0.349133  1
  P  P25  1  0.801647  0.645987  0.265990  1
  P  P26  1  0.568379  0.952237  0.349133  1
  P  P27  1  0.568379  0.618904  0.349133  1
  P  P28  1  0.085253  0.449794  0.485833  1
  P  P29  1  0.554839  0.503711  0.319166  1
  P  P30  1  0.085253  0.116460  0.485833  1
  P  P31  1  0.554839  0.170378  0.319166  1
  P  P32  1  0.085253  0.783127  0.485833  1
  P  P33  1  0.320046  0.476752  0.402500  1
  P  P34  1  0.554839  0.837044  0.319166  1
  P  P35  1  0.320046  0.143419  0.402500  1
  P  P36  1  0.320046  0.810086  0.402500  1
  P  P37  1  0.239898  0.270386  0.399438  1
  P  P38  1  0.005105  0.243428  0.482772  1
  P  P39  1  0.239898  0.937053  0.399438  1
  P  P40  1  0.005105  0.910094  0.482772  1
  P  P41  1  0.239898  0.603720  0.399438  1
  P  P42  1  0.474691  0.297345  0.316105  1
  P  P43  1  0.005105  0.576761  0.482772  1
  P  P44  1  0.474691  0.964012  0.316105  1
  P  P45  1  0.474691  0.630678  0.316105  1
  P  P46  1  0.883240  0.518919  0.268809  1
  P  P47  1  0.648527  0.491937  0.352195  1
  P  P48  1  0.883240  0.185586  0.268809  1
  P  P49  1  0.648527  0.158603  0.352195  1
  P  P50  1  0.883240  0.852252  0.268809  1
  P  P51  1  0.413734  0.464978  0.435528  1
  P  P52  1  0.648527  0.825270  0.352195  1
  P  P53  1  0.413734  0.131645  0.435528  1
  P  P54  1  0.413734  0.798311  0.435528  1
  P  P55  1  0.239536  0.235909  0.444517  1
  P  P56  1  0.709787  0.290474  0.277779  1
  P  P57  1  0.239536  0.902576  0.444517  1
  P  P58  1  0.709787  0.957140  0.277779  1
  P  P59  1  0.239536  0.569242  0.444517  1
  P  P60  1  0.474330  0.262868  0.361184  1
  P  P61  1  0.709787  0.623807  0.277779  1
  P  P62  1  0.474330  0.929534  0.361184  1
  P  P63  1  0.474330  0.596201  0.361184  1
  P  P64  1  0.179302  0.472497  0.473782  1
  P  P65  1  0.648889  0.526414  0.307116  1
  P  P66  1  0.179302  0.139163  0.473782  1
  P  P67  1  0.648889  0.193081  0.307116  1
  P  P68  1  0.179302  0.805830  0.473782  1
  P  P69  1  0.414096  0.499455  0.390449  1
  P  P70  1  0.648889  0.859747  0.307116  1
  P  P71  1  0.414096  0.166122  0.390449  1
  P  P72  1  0.414096  0.832789  0.390449  1
  P  P73  1  0.167684  0.372788  0.342525  1
  P  P74  1  0.932891  0.345829  0.425858  1
  P  P75  1  0.167684  0.039454  0.342525  1
  P  P76  1  0.932891  0.012496  0.425858  1
  P  P77  1  0.167684  0.706121  0.342525  1
  P  P78  1  0.405695  0.399636  0.260304  1
  P  P79  1  0.932891  0.679162  0.425858  1
  P  P80  1  0.405695  0.066302  0.260304  1
  P  P81  1  0.405695  0.732969  0.260304  1
  P  P82  1  0.955534  0.416494  0.325775  1
  P  P83  1  0.720741  0.389535  0.409108  1
  P  P84  1  0.955534  0.083161  0.325775  1
  P  P85  1  0.720741  0.056202  0.409108  1
  P  P86  1  0.955534  0.749827  0.325775  1
  P  P87  1  0.485948  0.362577  0.492442  1
  P  P88  1  0.720741  0.722869  0.409108  1
  P  P89  1  0.485948  0.029243  0.492442  1
  P  P90  1  0.485948  0.695910  0.492442  1
  P  P91  1  0.258827  0.369486  0.376541  1
  P  P92  1  0.024034  0.342527  0.459874  1
  P  P93  1  0.258827  0.036153  0.376541  1
  P  P94  1  0.024034  0.009194  0.459874  1
  P  P95  1  0.258827  0.702819  0.376541  1
  P  P96  1  0.490579  0.396558  0.292044  1
  P  P97  1  0.024034  0.675861  0.459874  1
  P  P98  1  0.490579  0.063225  0.292044  1
  P  P99  1  0.490579  0.729892  0.292044  1
  P  P100  1  0.864391  0.419796  0.291759  1
  P  P101  1  0.629598  0.392837  0.375092  1
  P  P102  1  0.864391  0.086462  0.291759  1
  P  P103  1  0.629598  0.059504  0.375092  1
  P  P104  1  0.864391  0.753129  0.291759  1
  P  P105  1  0.394805  0.365879  0.458426  1
  P  P106  1  0.629598  0.726170  0.375092  1
  P  P107  1  0.394805  0.032545  0.458426  1
  P  P108  1  0.394805  0.699212  0.458426  1
  P  P109  1  0.273117  0.340328  0.328041  1
  P  P110  1  0.038324  0.313369  0.411374  1
  P  P111  1  0.273117  0.006995  0.328041  1
  P  P112  1  0.038324  0.980036  0.411374  1
  P  P113  1  0.273117  0.673661  0.328041  1
  P  P114  1  0.803530  0.286411  0.494707  1
  P  P115  1  0.038324  0.646703  0.411374  1
  P  P116  1  0.803530  0.953078  0.494707  1
  P  P117  1  0.803530  0.619744  0.494707  1
  P  P118  1  0.850102  0.448954  0.340259  1
  P  P119  1  0.615308  0.421995  0.423592  1
  P  P120  1  0.850102  0.115620  0.340259  1
  P  P121  1  0.615308  0.088662  0.423592  1
  P  P122  1  0.850102  0.782287  0.340259  1
  P  P123  1  0.085647  0.473832  0.256847  1
  P  P124  1  0.615308  0.755328  0.423592  1
  P  P125  1  0.085647  0.140498  0.256847  1
  P  P126  1  0.085647  0.807165  0.256847  1
  P  P127  1  0.018633  0.374610  0.413019  1
  P  P128  1  0.783840  0.347651  0.496352  1
  P  P129  1  0.018633  0.041276  0.413019  1
  P  P130  1  0.783840  0.014318  0.496352  1
  P  P131  1  0.018633  0.707943  0.413019  1
  P  P132  1  0.253426  0.401568  0.329686  1
  P  P133  1  0.783840  0.680984  0.496352  1
  P  P134  1  0.253426  0.068235  0.329686  1
  P  P135  1  0.253426  0.734902  0.329686  1
  P  P136  1  0.104009  0.416756  0.255309  1
  P  P137  1  0.869792  0.387713  0.338614  1
  P  P138  1  0.104009  0.083422  0.255309  1
  P  P139  1  0.869792  0.054380  0.338614  1
  P  P140  1  0.104009  0.750089  0.255309  1
  P  P141  1  0.634999  0.360755  0.421947  1
  P  P142  1  0.869792  0.721047  0.338614  1
  P  P143  1  0.634999  0.027421  0.421947  1
  P  P144  1  0.634999  0.694088  0.421947  1
  P  P145  1  0.046014  0.258628  0.274259  1
  P  P146  1  0.811221  0.231669  0.357592  1
  P  P147  1  0.046014  0.925294  0.274259  1
  P  P148  1  0.811221  0.898336  0.357592  1
  P  P149  1  0.046014  0.591961  0.274259  1
  P  P150  1  0.576428  0.204711  0.440925  1
  P  P151  1  0.811221  0.565003  0.357592  1
  P  P152  1  0.576428  0.871377  0.440925  1
  P  P153  1  0.576428  0.538044  0.440925  1
  P  P154  1  0.077204  0.530654  0.394041  1
  P  P155  1  0.842411  0.503695  0.477374  1
  P  P156  1  0.077204  0.197321  0.394041  1
  P  P157  1  0.842411  0.170362  0.477374  1
  P  P158  1  0.077204  0.863987  0.394041  1
  P  P159  1  0.311997  0.557612  0.310708  1
  P  P160  1  0.842411  0.837029  0.477374  1
  P  P161  1  0.311997  0.224279  0.310708  1
  P  P162  1  0.311997  0.890946  0.310708  1
  P  P163  1  0.124119  0.293826  0.266843  1
  P  P164  1  0.889326  0.266868  0.350177  1
  P  P165  1  0.124119  0.960493  0.266843  1
  P  P166  1  0.889326  0.933534  0.350177  1
  P  P167  1  0.124119  0.627160  0.266843  1
  P  P168  1  0.654533  0.239909  0.433510  1
  P  P169  1  0.889326  0.600201  0.350177  1
  P  P170  1  0.654533  0.906576  0.433510  1
  P  P171  1  0.654533  0.573243  0.433510  1
  P  P172  1  0.999099  0.495455  0.401456  1
  P  P173  1  0.764306  0.468497  0.484790  1
  P  P174  1  0.999099  0.162122  0.401456  1
  P  P175  1  0.764306  0.135163  0.484790  1
  P  P176  1  0.999099  0.828789  0.401456  1
  P  P177  1  0.233893  0.522414  0.318123  1
  P  P178  1  0.764306  0.801830  0.484790  1
  P  P179  1  0.233893  0.189080  0.318123  1
  P  P180  1  0.233893  0.855747  0.318123  1
  P  P181  1  0.094949  0.279957  0.317873  1
  P  P182  1  0.860156  0.252998  0.401206  1
  P  P183  1  0.094949  0.946623  0.317873  1
  P  P184  1  0.860156  0.919665  0.401206  1
  P  P185  1  0.094949  0.613290  0.317873  1
  P  P186  1  0.625363  0.226040  0.484539  1
  P  P187  1  0.860156  0.586332  0.401206  1
  P  P188  1  0.625363  0.892706  0.484539  1
  P  P189  1  0.625363  0.559373  0.484539  1
  P  P190  1  0.028269  0.509325  0.350427  1
  P  P191  1  0.793476  0.482366  0.433760  1
  P  P192  1  0.028269  0.175992  0.350427  1
  P  P193  1  0.793476  0.149033  0.433760  1
  P  P194  1  0.028269  0.842658  0.350427  1
  P  P195  1  0.263062  0.536283  0.267094  1
  P  P196  1  0.793476  0.815700  0.433760  1
  P  P197  1  0.263062  0.202950  0.267094  1
  P  P198  1  0.263062  0.869617  0.267094  1
  P  P199  1  0.017804  0.318327  0.286744  1
  P  P200  1  0.783011  0.291368  0.370077  1
  P  P201  1  0.017804  0.984993  0.286744  1
  P  P202  1  0.783011  0.958035  0.370077  1
  P  P203  1  0.017804  0.651660  0.286744  1
  P  P204  1  0.548218  0.264409  0.453411  1
  P  P205  1  0.783011  0.624701  0.370077  1
  P  P206  1  0.548218  0.931076  0.453411  1
  P  P207  1  0.548218  0.597743  0.453411  1
  P  P208  1  0.105414  0.470955  0.381556  1
  P  P209  1  0.870621  0.443997  0.464889  1
  P  P210  1  0.105414  0.137622  0.381556  1
  P  P211  1  0.870621  0.110663  0.464889  1
  P  P212  1  0.105414  0.804288  0.381556  1
  P  P213  1  0.340207  0.497914  0.298222  1
  P  P214  1  0.870621  0.777330  0.464889  1
  P  P215  1  0.340207  0.164580  0.298222  1
  P  P216  1  0.340207  0.831247  0.298222  1
  P  P217  1  0.530578  0.215185  0.699449  1
  P  P218  1  1.000164  0.269103  0.532783  1
  P  P219  1  0.530578  0.881852  0.699449  1
  P  P220  1  1.000164  0.935769  0.532783  1
  P  P221  1  0.530578  0.548519  0.699449  1
  P  P222  1  0.765371  0.242144  0.616116  1
  P  P223  1  1.000164  0.602436  0.532783  1
  P  P224  1  0.765371  0.908811  0.616116  1
  P  P225  1  0.765371  0.575477  0.616116  1
  P  P226  1  0.478721  0.332217  0.719021  1
  P  P227  1  0.949089  0.385386  0.552184  1
  P  P228  1  0.478721  0.998883  0.719021  1
  P  P229  1  0.949089  0.052053  0.552184  1
  P  P230  1  0.478721  0.665550  0.719021  1
  P  P231  1  0.714296  0.358427  0.635517  1
  P  P232  1  0.949089  0.718719  0.552184  1
  P  P233  1  0.714296  0.025094  0.635517  1
  P  P234  1  0.714296  0.691761  0.635517  1
  P  P235  1  0.629206  0.177736  0.682467  1
  P  P236  1  0.098793  0.231653  0.515800  1
  P  P237  1  0.629206  0.844403  0.682467  1
  P  P238  1  0.098793  0.898320  0.515800  1
  P  P239  1  0.629206  0.511070  0.682467  1
  P  P240  1  0.864000  0.204695  0.599133  1
  P  P241  1  0.098793  0.564987  0.515800  1
  P  P242  1  0.864000  0.871361  0.599133  1
  P  P243  1  0.864000  0.538028  0.599133  1
  P  P244  1  0.382399  0.368794  0.735643  1
  P  P245  1  0.850460  0.422835  0.569166  1
  P  P246  1  0.382399  0.035460  0.735643  1
  P  P247  1  0.850460  0.089502  0.569166  1
  P  P248  1  0.382399  0.702127  0.735643  1
  P  P249  1  0.615667  0.395877  0.652500  1
  P  P250  1  0.850460  0.756169  0.569166  1
  P  P251  1  0.615667  0.062543  0.652500  1
  P  P252  1  0.615667  0.729210  0.652500  1
  P  P253  1  0.535519  0.189511  0.649438  1
  P  P254  1  0.300805  0.162528  0.732824  1
  P  P255  1  0.535519  0.856177  0.649438  1
  P  P256  1  0.300805  0.829195  0.732824  1
  P  P257  1  0.535519  0.522844  0.649438  1
  P  P258  1  0.770312  0.216469  0.566105  1
  P  P259  1  0.300805  0.495861  0.732824  1
  P  P260  1  0.770312  0.883136  0.566105  1
  P  P261  1  0.770312  0.549802  0.566105  1
  P  P262  1  0.178941  0.438019  0.518861  1
  P  P263  1  0.944147  0.411061  0.602195  1
  P  P264  1  0.178941  0.104686  0.518861  1
  P  P265  1  0.944147  0.077728  0.602195  1
  P  P266  1  0.178941  0.771353  0.518861  1
  P  P267  1  0.709354  0.384102  0.685528  1
  P  P268  1  0.944147  0.744394  0.602195  1
  P  P269  1  0.709354  0.050769  0.685528  1
  P  P270  1  0.709354  0.717436  0.685528  1
  P  P271  1  0.535157  0.155033  0.694517  1
  P  P272  1  0.004743  0.208950  0.527851  1
  P  P273  1  0.535157  0.821700  0.694517  1
  P  P274  1  0.004743  0.875617  0.527851  1
  P  P275  1  0.535157  0.488367  0.694517  1
  P  P276  1  0.769950  0.181992  0.611184  1
  P  P277  1  0.004743  0.542284  0.527851  1
  P  P278  1  0.769950  0.848659  0.611184  1
  P  P279  1  0.769950  0.515325  0.611184  1
  P  P280  1  0.474259  0.390974  0.723854  1
  P  P281  1  0.944509  0.445538  0.557116  1
  P  P282  1  0.474259  0.057640  0.723854  1
  P  P283  1  0.944509  0.112205  0.557116  1
  P  P284  1  0.474259  0.724307  0.723854  1
  P  P285  1  0.709716  0.418580  0.640449  1
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