# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   54.78516107
_cell_length_b   103.75447657
_cell_length_c   49.22924337
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   86.73690789
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P1296
_cell_volume   279375.456556
_cell_formula_units_Z   1296
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  0.690667  0.902011  0.306295  1
  P  P2  1  0.357334  0.735344  0.306295  1
  P  P3  1  0.334399  0.894095  0.353653  1
  P  P4  1  0.690667  0.402011  0.306295  1
  P  P5  1  0.667733  0.560761  0.353653  1
  P  P6  1  0.644998  0.719886  0.401272  1
  P  P7  1  0.024001  0.568678  0.306295  1
  P  P8  1  1.001066  0.727428  0.353653  1
  P  P9  1  0.978331  0.886552  0.401272  1
  P  P10  1  0.357334  0.235344  0.306295  1
  P  P11  1  0.334399  0.394095  0.353653  1
  P  P12  1  0.311665  0.553219  0.401272  1
  P  P13  1  0.667733  0.060761  0.353653  1
  P  P14  1  0.644998  0.219886  0.401272  1
  P  P15  1  0.024001  0.068678  0.306295  1
  P  P16  1  1.001066  0.227428  0.353653  1
  P  P17  1  0.978331  0.386552  0.401272  1
  P  P18  1  0.311665  0.053219  0.401272  1
  P  P19  1  0.639632  0.823892  0.410187  1
  P  P20  1  0.306299  0.657226  0.410187  1
  P  P21  1  0.351508  0.838605  0.315083  1
  P  P22  1  0.639632  0.323892  0.410187  1
  P  P23  1  0.684842  0.505272  0.315083  1
  P  P24  1  0.662367  0.664768  0.362568  1
  P  P25  1  0.972966  0.490559  0.410187  1
  P  P26  1  0.018175  0.671938  0.315083  1
  P  P27  1  0.995700  0.831435  0.362568  1
  P  P28  1  0.306299  0.157226  0.410187  1
  P  P29  1  0.351508  0.338605  0.315083  1
  P  P30  1  0.329034  0.498102  0.362568  1
  P  P31  1  0.684842  0.005272  0.315083  1
  P  P32  1  0.662367  0.164768  0.362568  1
  P  P33  1  0.972966  0.990559  0.410187  1
  P  P34  1  0.018175  0.171938  0.315083  1
  P  P35  1  0.995700  0.331435  0.362568  1
  P  P36  1  0.329034  0.998102  0.362568  1
  P  P37  1  0.620261  0.905452  0.417746  1
  P  P38  1  0.286927  0.738785  0.417746  1
  P  P39  1  0.332397  0.920537  0.322508  1
  P  P40  1  0.620261  0.405452  0.417746  1
  P  P41  1  0.665730  0.587204  0.322508  1
  P  P42  1  0.642995  0.746328  0.370127  1
  P  P43  1  0.953594  0.572119  0.417746  1
  P  P44  1  0.999063  0.753870  0.322508  1
  P  P45  1  0.976329  0.912994  0.370127  1
  P  P46  1  0.286927  0.238785  0.417746  1
  P  P47  1  0.332397  0.420537  0.322508  1
  P  P48  1  0.309662  0.579661  0.370127  1
  P  P49  1  0.665730  0.087204  0.322508  1
  P  P50  1  0.642995  0.246328  0.370127  1
  P  P51  1  0.953594  0.072119  0.417746  1
  P  P52  1  0.999063  0.253870  0.322508  1
  P  P53  1  0.976329  0.412994  0.370127  1
  P  P54  1  0.309662  0.079661  0.370127  1
  P  P55  1  0.709795  0.820123  0.298410  1
  P  P56  1  0.376462  0.653456  0.298410  1
  P  P57  1  0.353427  0.812791  0.345564  1
  P  P58  1  0.709795  0.320123  0.298410  1
  P  P59  1  0.686761  0.479457  0.345564  1
  P  P60  1  0.664369  0.638326  0.393713  1
  P  P61  1  0.043128  0.486790  0.298410  1
  P  P62  1  0.020094  0.646124  0.345564  1
  P  P63  1  0.997703  0.804993  0.393713  1
  P  P64  1  0.376462  0.153456  0.298410  1
  P  P65  1  0.353427  0.312791  0.345564  1
  P  P66  1  0.331036  0.471659  0.393713  1
  P  P67  1  0.686761  0.979457  0.345564  1
  P  P68  1  0.664369  0.138326  0.393713  1
  P  P69  1  0.043128  0.986790  0.298410  1
  P  P70  1  0.020094  0.146124  0.345564  1
  P  P71  1  0.997703  0.304993  0.393713  1
  P  P72  1  0.331036  0.971659  0.393713  1
  P  P73  1  0.730720  0.921027  0.315470  1
  P  P74  1  0.397387  0.754360  0.315470  1
  P  P75  1  0.375395  0.913568  0.363019  1
  P  P76  1  0.730720  0.421027  0.315470  1
  P  P77  1  0.708728  0.580234  0.363019  1
  P  P78  1  0.685993  0.739359  0.410638  1
  P  P79  1  0.064053  0.587693  0.315470  1
  P  P80  1  0.042061  0.746901  0.363019  1
  P  P81  1  0.019327  0.906025  0.410638  1
  P  P82  1  0.397387  0.254360  0.315470  1
  P  P83  1  0.375395  0.413568  0.363019  1
  P  P84  1  0.352660  0.572692  0.410638  1
  P  P85  1  0.708728  0.080234  0.363019  1
  P  P86  1  0.685993  0.239359  0.410638  1
  P  P87  1  0.064053  0.087693  0.315470  1
  P  P88  1  0.042061  0.246901  0.363019  1
  P  P89  1  0.019327  0.406025  0.410638  1
  P  P90  1  0.352660  0.072692  0.410638  1
  P  P91  1  0.598637  0.804419  0.400820  1
  P  P92  1  0.265304  0.637753  0.400820  1
  P  P93  1  0.311470  0.819580  0.305921  1
  P  P94  1  0.598637  0.304419  0.400820  1
  P  P95  1  0.644803  0.486246  0.305921  1
  P  P96  1  0.621372  0.645295  0.353201  1
  P  P97  1  0.931970  0.471086  0.400820  1
  P  P98  1  0.978137  0.652913  0.305921  1
  P  P99  1  0.954705  0.811962  0.353201  1
  P  P100  1  0.265304  0.137753  0.400820  1
  P  P101  1  0.311470  0.319580  0.305921  1
  P  P102  1  0.288038  0.478629  0.353201  1
  P  P103  1  0.644803  0.986246  0.305921  1
  P  P104  1  0.621372  0.145295  0.353201  1
  P  P105  1  0.931970  0.971086  0.400820  1
  P  P106  1  0.978137  0.152913  0.305921  1
  P  P107  1  0.954705  0.311962  0.353201  1
  P  P108  1  0.288038  0.978629  0.353201  1
  P  P109  1  0.678948  0.927255  0.337258  1
  P  P110  1  0.345615  0.760588  0.337258  1
  P  P111  1  0.322381  0.919957  0.385272  1
  P  P112  1  0.678948  0.427255  0.337258  1
  P  P113  1  0.655715  0.586624  0.385272  1
  P  P114  1  0.701278  0.768334  0.289977  1
  P  P115  1  0.012281  0.593922  0.337258  1
  P  P116  1  0.989048  0.753290  0.385272  1
  P  P117  1  0.034611  0.935000  0.289977  1
  P  P118  1  0.345615  0.260588  0.337258  1
  P  P119  1  0.322381  0.419957  0.385272  1
  P  P120  1  0.367945  0.601667  0.289977  1
  P  P121  1  0.655715  0.086624  0.385272  1
  P  P122  1  0.701278  0.268334  0.289977  1
  P  P123  1  0.012281  0.093922  0.337258  1
  P  P124  1  0.989048  0.253290  0.385272  1
  P  P125  1  0.034611  0.435000  0.289977  1
  P  P126  1  0.367945  0.101667  0.289977  1
  P  P127  1  0.651650  0.798030  0.378568  1
  P  P128  1  0.318317  0.631363  0.378568  1
  P  P129  1  0.295582  0.790488  0.426187  1
  P  P130  1  0.651650  0.298030  0.378568  1
  P  P131  1  0.628915  0.457154  0.426187  1
  P  P132  1  0.674385  0.638906  0.330949  1
  P  P133  1  0.984983  0.464697  0.378568  1
  P  P134  1  0.962249  0.623821  0.426187  1
  P  P135  1  0.007718  0.805573  0.330949  1
  P  P136  1  0.318317  0.131363  0.378568  1
  P  P137  1  0.295582  0.290488  0.426187  1
  P  P138  1  0.341051  0.472239  0.330949  1
  P  P139  1  0.628915  0.957154  0.426187  1
  P  P140  1  0.674385  0.138906  0.330949  1
  P  P141  1  0.984983  0.964697  0.378568  1
  P  P142  1  0.962249  0.123821  0.426187  1
  P  P143  1  0.007718  0.305573  0.330949  1
  P  P144  1  0.341051  0.972239  0.330949  1
  P  P145  1  0.820187  0.882881  0.291545  1
  P  P146  1  0.486854  0.716215  0.291545  1
  P  P147  1  0.463815  0.875516  0.338627  1
  P  P148  1  0.820187  0.382881  0.291545  1
  P  P149  1  0.797149  0.542183  0.338627  1
  P  P150  1  0.774758  0.701096  0.386852  1
  P  P151  1  0.153520  0.549548  0.291545  1
  P  P152  1  0.130482  0.708850  0.338627  1
  P  P153  1  0.108091  0.867763  0.386852  1
  P  P154  1  0.486854  0.216215  0.291545  1
  P  P155  1  0.463815  0.375516  0.338627  1
  P  P156  1  0.441424  0.534430  0.386852  1
  P  P157  1  0.797149  0.042183  0.338627  1
  P  P158  1  0.774758  0.201096  0.386852  1
  P  P159  1  0.153520  0.049548  0.291545  1
  P  P160  1  0.130482  0.208850  0.338627  1
  P  P161  1  0.108091  0.367763  0.386852  1
  P  P162  1  0.441424  0.034430  0.386852  1
  P  P163  1  0.509872  0.842682  0.424606  1
  P  P164  1  0.176539  0.676015  0.424606  1
  P  P165  1  0.222009  0.857767  0.329368  1
  P  P166  1  0.509872  0.342682  0.424606  1
  P  P167  1  0.555342  0.524434  0.329368  1
  P  P168  1  0.532607  0.683558  0.376987  1
  P  P169  1  0.843206  0.509348  0.424606  1
  P  P170  1  0.888675  0.691100  0.329368  1
  P  P171  1  0.865940  0.850224  0.376987  1
  P  P172  1  0.176539  0.176015  0.424606  1
  P  P173  1  0.222009  0.357767  0.329368  1
  P  P174  1  0.199274  0.516891  0.376987  1
  P  P175  1  0.555342  0.024434  0.329368  1
  P  P176  1  0.532607  0.183558  0.376987  1
  P  P177  1  0.843206  0.009348  0.424606  1
  P  P178  1  0.888675  0.191100  0.329368  1
  P  P179  1  0.865940  0.350224  0.376987  1
  P  P180  1  0.199274  0.016891  0.376987  1
  P  P181  1  0.710593  0.863339  0.390515  1
  P  P182  1  0.377260  0.696672  0.390515  1
  P  P183  1  0.423393  0.878542  0.295629  1
  P  P184  1  0.710593  0.363339  0.390515  1
  P  P185  1  0.756726  0.545209  0.295629  1
  P  P186  1  0.733328  0.704215  0.342896  1
  P  P187  1  0.043926  0.530005  0.390515  1
  P  P188  1  0.090060  0.711876  0.295629  1
  P  P189  1  0.066661  0.870881  0.342896  1
  P  P190  1  0.377260  0.196672  0.390515  1
  P  P191  1  0.423393  0.378542  0.295629  1
  P  P192  1  0.399994  0.537548  0.342896  1
  P  P193  1  0.756726  0.045209  0.295629  1
  P  P194  1  0.733328  0.204215  0.342896  1
  P  P195  1  0.043926  0.030005  0.390515  1
  P  P196  1  0.090060  0.211876  0.295629  1
  P  P197  1  0.066661  0.370881  0.342896  1
  P  P198  1  0.399994  0.037548  0.342896  1
  P  P199  1  0.618778  0.862081  0.325762  1
  P  P200  1  0.285445  0.695415  0.325762  1
  P  P201  1  0.263439  0.854648  0.373325  1
  P  P202  1  0.618778  0.362081  0.325762  1
  P  P203  1  0.596772  0.521315  0.373325  1
  P  P204  1  0.574037  0.680439  0.420944  1
  P  P205  1  0.952112  0.528748  0.325762  1
  P  P206  1  0.930105  0.687982  0.373325  1
  P  P207  1  0.907371  0.847106  0.420944  1
  P  P208  1  0.285445  0.195415  0.325762  1
  P  P209  1  0.263439  0.354648  0.373325  1
  P  P210  1  0.240704  0.513772  0.420944  1
  P  P211  1  0.596772  0.021315  0.373325  1
  P  P212  1  0.574037  0.180439  0.420944  1
  P  P213  1  0.952112  0.028748  0.325762  1
  P  P214  1  0.930105  0.187982  0.373325  1
  P  P215  1  0.907371  0.347106  0.420944  1
  P  P216  1  0.240704  0.013772  0.420944  1
  P  P217  1  0.748396  0.884758  0.397059  1
  P  P218  1  0.415062  0.718091  0.397059  1
  P  P219  1  0.460317  0.899467  0.302025  1
  P  P220  1  0.748396  0.384758  0.397059  1
  P  P221  1  0.793650  0.566133  0.302025  1
  P  P222  1  0.771130  0.725633  0.349440  1
  P  P223  1  0.081729  0.551424  0.397059  1
  P  P224  1  0.126983  0.732800  0.302025  1
  P  P225  1  0.104464  0.892300  0.349440  1
  P  P226  1  0.415062  0.218091  0.397059  1
  P  P227  1  0.460317  0.399467  0.302025  1
  P  P228  1  0.437797  0.558967  0.349440  1
  P  P229  1  0.793650  0.066133  0.302025  1
  P  P230  1  0.771130  0.225633  0.349440  1
  P  P231  1  0.081729  0.051424  0.397059  1
  P  P232  1  0.126983  0.232800  0.302025  1
  P  P233  1  0.104464  0.392300  0.349440  1
  P  P234  1  0.437797  0.058967  0.349440  1
  P  P235  1  0.581846  0.841162  0.319349  1
  P  P236  1  0.248513  0.674496  0.319349  1
  P  P237  1  0.225636  0.833230  0.366781  1
  P  P238  1  0.581846  0.341162  0.319349  1
  P  P239  1  0.558969  0.499896  0.366781  1
  P  P240  1  0.536235  0.659020  0.414400  1
  P  P241  1  0.915180  0.507829  0.319349  1
  P  P242  1  0.892303  0.666563  0.366781  1
  P  P243  1  0.869568  0.825687  0.414400  1
  P  P244  1  0.248513  0.174496  0.319349  1
  P  P245  1  0.225636  0.333230  0.366781  1
  P  P246  1  0.202901  0.492354  0.414400  1
  P  P247  1  0.558969  0.999896  0.366781  1
  P  P248  1  0.536235  0.159020  0.414400  1
  P  P249  1  0.915180  0.007829  0.319349  1
  P  P250  1  0.892303  0.166563  0.366781  1
  P  P251  1  0.869568  0.325687  0.414400  1
  P  P252  1  0.202901  0.992354  0.414400  1
  P  P253  1  0.765152  0.857755  0.372546  1
  P  P254  1  0.431819  0.691088  0.372546  1
  P  P255  1  0.409084  0.850212  0.420165  1
  P  P256  1  0.765152  0.357755  0.372546  1
  P  P257  1  0.742418  0.516879  0.420165  1
  P  P258  1  0.787887  0.698631  0.324927  1
  P  P259  1  0.098486  0.524421  0.372546  1
  P  P260  1  0.075751  0.683546  0.420165  1
  P  P261  1  0.121220  0.865297  0.324927  1
  P  P262  1  0.431819  0.191088  0.372546  1
  P  P263  1  0.409084  0.350212  0.420165  1
  P  P264  1  0.454554  0.531964  0.324927  1
  P  P265  1  0.742418  0.016879  0.420165  1
  P  P266  1  0.787887  0.198631  0.324927  1
  P  P267  1  0.098486  0.024421  0.372546  1
  P  P268  1  0.075751  0.183546  0.420165  1
  P  P269  1  0.121220  0.365297  0.324927  1
  P  P270  1  0.454554  0.031964  0.324927  1
  P  P271  1  0.565493  0.867528  0.343362  1
  P  P272  1  0.232159  0.700861  0.343362  1
  P  P273  1  0.208879  0.860232  0.391294  1
  P  P274  1  0.565493  0.367528  0.343362  1
  P  P275  1  0.542213  0.526899  0.391294  1
  P  P276  1  0.587788  0.708604  0.296005  1
  P  P277  1  0.898826  0.534195  0.343362  1
  P  P278  1  0.875546  0.693566  0.391294  1
  P  P279  1  0.921121  0.875271  0.296005  1
  P  P280  1  0.232159  0.200861  0.343362  1
  P  P281  1  0.208879  0.360232  0.391294  1
  P  P282  1  0.254454  0.541938  0.296005  1
  P  P283  1  0.542213  0.026899  0.391294  1
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  P  P1296  1  0.299304  0.937190  0.651238  1
