# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.89982501
_cell_length_b   35.31152582
_cell_length_c   48.81557969
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   85.89253000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P384
_cell_volume   22178.9924435
_cell_formula_units_Z   384
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  0.763544  0.706203  0.303323  1
  P  P2  1  0.263544  0.706203  0.303323  1
  P  P3  1  0.931635  1.033508  0.290863  1
  P  P4  1  0.851040  0.362968  0.278698  1
  P  P5  1  0.431635  1.033508  0.290863  1
  P  P6  1  0.351040  0.362968  0.278698  1
  P  P7  1  0.828809  0.947998  0.284698  1
  P  P8  1  0.328809  0.947998  0.284698  1
  P  P9  1  -0.002311  0.278972  0.273780  1
  P  P10  1  0.909814  0.619403  0.297133  1
  P  P11  1  0.497689  0.278972  0.273780  1
  P  P12  1  0.409814  0.619403  0.297133  1
  P  P13  1  0.226040  0.862968  0.278698  1
  P  P14  1  0.726040  0.862968  0.278698  1
  P  P15  1  0.138544  0.206203  0.303323  1
  P  P16  1  0.056635  0.533508  0.290863  1
  P  P17  1  0.638544  0.206203  0.303323  1
  P  P18  1  0.556635  0.533508  0.290863  1
  P  P19  1  0.122689  0.778972  0.273780  1
  P  P20  1  0.622689  0.778972  0.273780  1
  P  P21  1  0.034814  1.119403  0.297133  1
  P  P22  1  0.203809  0.447998  0.284698  1
  P  P23  1  0.534814  1.119403  0.297133  1
  P  P24  1  0.703809  0.447998  0.284698  1
  P  P25  1  0.976040  0.862968  0.278698  1
  P  P26  1  0.476040  0.862968  0.278698  1
  P  P27  1  0.888544  0.206203  0.303323  1
  P  P28  1  0.806635  0.533508  0.290863  1
  P  P29  1  0.388544  0.206203  0.303323  1
  P  P30  1  0.306635  0.533508  0.290863  1
  P  P31  1  0.872689  0.778972  0.273780  1
  P  P32  1  0.372689  0.778972  0.273780  1
  P  P33  1  0.784814  1.119403  0.297133  1
  P  P34  1  0.953809  0.447998  0.284698  1
  P  P35  1  0.284814  1.119403  0.297133  1
  P  P36  1  0.453809  0.447998  0.284698  1
  P  P37  1  0.013544  0.706203  0.303323  1
  P  P38  1  0.513544  0.706203  0.303323  1
  P  P39  1  0.181635  1.033508  0.290863  1
  P  P40  1  0.101040  0.362968  0.278698  1
  P  P41  1  0.681635  1.033508  0.290863  1
  P  P42  1  0.601040  0.362968  0.278698  1
  P  P43  1  0.078809  0.947998  0.284698  1
  P  P44  1  0.578809  0.947998  0.284698  1
  P  P45  1  0.247689  0.278972  0.273780  1
  P  P46  1  0.159814  0.619403  0.297133  1
  P  P47  1  0.747689  0.278972  0.273780  1
  P  P48  1  0.659814  0.619403  0.297133  1
  P  P49  1  0.635329  0.729931  0.359991  1
  P  P50  1  0.135329  0.729931  0.359991  1
  P  P51  1  0.804358  1.058105  0.347087  1
  P  P52  1  0.723641  0.386578  0.334926  1
  P  P53  1  0.304358  1.058105  0.347087  1
  P  P54  1  0.223641  0.386578  0.334926  1
  P  P55  1  0.701566  0.972275  0.340957  1
  P  P56  1  0.201566  0.972275  0.340957  1
  P  P57  1  0.870501  0.300924  0.329269  1
  P  P58  1  0.782160  0.644079  0.353288  1
  P  P59  1  0.370501  0.300924  0.329269  1
  P  P60  1  0.282160  0.644079  0.353288  1
  P  P61  1  0.098641  0.886578  0.334926  1
  P  P62  1  0.598641  0.886578  0.334926  1
  P  P63  1  0.010329  0.229931  0.359991  1
  P  P64  1  0.929358  0.558105  0.347087  1
  P  P65  1  0.510329  0.229931  0.359991  1
  P  P66  1  0.429358  0.558105  0.347087  1
  P  P67  1  -0.004499  0.800924  0.329269  1
  P  P68  1  0.495501  0.800924  0.329269  1
  P  P69  1  0.907160  0.144079  0.353288  1
  P  P70  1  0.076566  0.472275  0.340957  1
  P  P71  1  0.407160  0.144079  0.353288  1
  P  P72  1  0.576566  0.472275  0.340957  1
  P  P73  1  0.848641  0.886578  0.334926  1
  P  P74  1  0.348641  0.886578  0.334926  1
  P  P75  1  0.760329  0.229931  0.359991  1
  P  P76  1  0.679358  0.558105  0.347087  1
  P  P77  1  0.260329  0.229931  0.359991  1
  P  P78  1  0.179358  0.558105  0.347087  1
  P  P79  1  0.745501  0.800924  0.329269  1
  P  P80  1  0.245501  0.800924  0.329269  1
  P  P81  1  0.657160  0.144079  0.353288  1
  P  P82  1  0.826566  0.472275  0.340957  1
  P  P83  1  0.157160  0.144079  0.353288  1
  P  P84  1  0.326566  0.472275  0.340957  1
  P  P85  1  0.885329  0.729931  0.359991  1
  P  P86  1  0.385329  0.729931  0.359991  1
  P  P87  1  0.054358  1.058105  0.347087  1
  P  P88  1  0.973641  0.386578  0.334926  1
  P  P89  1  0.554358  1.058105  0.347087  1
  P  P90  1  0.473641  0.386578  0.334926  1
  P  P91  1  0.951566  0.972275  0.340957  1
  P  P92  1  0.451566  0.972275  0.340957  1
  P  P93  1  0.120501  0.300924  0.329269  1
  P  P94  1  0.032160  0.644079  0.353288  1
  P  P95  1  0.620501  0.300924  0.329269  1
  P  P96  1  0.532160  0.644079  0.353288  1
  P  P97  1  0.507711  0.753923  0.416957  1
  P  P98  1  0.007711  0.753923  0.416957  1
  P  P99  1  0.677079  1.082151  0.404050  1
  P  P100  1  0.596138  0.410487  0.391752  1
  P  P101  1  0.177079  1.082151  0.404050  1
  P  P102  1  0.096138  0.410487  0.391752  1
  P  P103  1  0.574153  0.996323  0.397885  1
  P  P104  1  0.074153  0.996323  0.397885  1
  P  P105  1  0.743231  0.324578  0.385678  1
  P  P106  1  0.654973  0.667945  0.410364  1
  P  P107  1  0.243231  0.324578  0.385678  1
  P  P108  1  0.154973  0.667945  0.410364  1
  P  P109  1  0.971138  0.910487  0.391752  1
  P  P110  1  0.471138  0.910487  0.391752  1
  P  P111  1  0.882711  0.253923  0.416957  1
  P  P112  1  0.802079  0.582151  0.404050  1
  P  P113  1  0.382711  0.253923  0.416957  1
  P  P114  1  0.302079  0.582151  0.404050  1
  P  P115  1  0.868231  0.824578  0.385678  1
  P  P116  1  0.368231  0.824578  0.385678  1
  P  P117  1  0.779973  0.167945  0.410364  1
  P  P118  1  0.949153  0.496323  0.397885  1
  P  P119  1  0.279973  0.167945  0.410364  1
  P  P120  1  0.449153  0.496323  0.397885  1
  P  P121  1  0.721138  0.910487  0.391752  1
  P  P122  1  0.221138  0.910487  0.391752  1
  P  P123  1  0.632711  0.253923  0.416957  1
  P  P124  1  0.552079  0.582151  0.404050  1
  P  P125  1  0.132711  0.253923  0.416957  1
  P  P126  1  0.052079  0.582151  0.404050  1
  P  P127  1  0.618231  0.824578  0.385678  1
  P  P128  1  0.118231  0.824578  0.385678  1
  P  P129  1  0.529973  0.167945  0.410364  1
  P  P130  1  0.699153  0.496323  0.397885  1
  P  P131  1  0.029973  0.167945  0.410364  1
  P  P132  1  0.199153  0.496323  0.397885  1
  P  P133  1  0.757711  0.753923  0.416957  1
  P  P134  1  0.257711  0.753923  0.416957  1
  P  P135  1  0.927079  1.082151  0.404050  1
  P  P136  1  0.846138  0.410487  0.391752  1
  P  P137  1  0.427079  1.082151  0.404050  1
  P  P138  1  0.346138  0.410487  0.391752  1
  P  P139  1  0.824153  0.996323  0.397885  1
  P  P140  1  0.324153  0.996323  0.397885  1
  P  P141  1  -0.006769  0.324578  0.385678  1
  P  P142  1  0.904973  0.667945  0.410364  1
  P  P143  1  0.493231  0.324578  0.385678  1
  P  P144  1  0.404973  0.667945  0.410364  1
  P  P145  1  0.380347  0.777864  0.473780  1
  P  P146  1  0.880347  0.777864  0.473780  1
  P  P147  1  0.549757  1.106014  0.460997  1
  P  P148  1  0.468687  0.434373  0.448546  1
  P  P149  1  0.049757  1.106014  0.460997  1
  P  P150  1  0.968687  0.434373  0.448546  1
  P  P151  1  0.446705  1.020229  0.454775  1
  P  P152  1  0.946705  1.020229  0.454775  1
  P  P153  1  0.615980  0.348367  0.442221  1
  P  P154  1  0.527720  0.691849  0.467296  1
  P  P155  1  0.115980  0.348367  0.442221  1
  P  P156  1  0.027720  0.691849  0.467296  1
  P  P157  1  0.843687  0.934373  0.448546  1
  P  P158  1  0.343687  0.934373  0.448546  1
  P  P159  1  0.755347  0.277864  0.473780  1
  P  P160  1  0.674757  0.606014  0.460997  1
  P  P161  1  0.255347  0.277864  0.473780  1
  P  P162  1  0.174757  0.606014  0.460997  1
  P  P163  1  0.740980  0.848367  0.442221  1
  P  P164  1  0.240980  0.848367  0.442221  1
  P  P165  1  0.652720  0.191849  0.467296  1
  P  P166  1  0.821705  0.520229  0.454775  1
  P  P167  1  0.152720  0.191849  0.467296  1
  P  P168  1  0.321705  0.520229  0.454775  1
  P  P169  1  0.593687  0.934373  0.448546  1
  P  P170  1  0.093687  0.934373  0.448546  1
  P  P171  1  0.505347  0.277864  0.473780  1
  P  P172  1  0.424757  0.606014  0.460997  1
  P  P173  1  0.005347  0.277864  0.473780  1
  P  P174  1  0.924757  0.606014  0.460997  1
  P  P175  1  0.490980  0.848367  0.442221  1
  P  P176  1  -0.009020  0.848367  0.442221  1
  P  P177  1  0.402720  0.191849  0.467296  1
  P  P178  1  0.571705  0.520229  0.454775  1
  P  P179  1  0.902720  0.191849  0.467296  1
  P  P180  1  0.071705  0.520229  0.454775  1
  P  P181  1  0.630347  0.777864  0.473780  1
  P  P182  1  0.130347  0.777864  0.473780  1
  P  P183  1  0.799757  1.106014  0.460997  1
  P  P184  1  0.718687  0.434373  0.448546  1
  P  P185  1  0.299757  1.106014  0.460997  1
  P  P186  1  0.218687  0.434373  0.448546  1
  P  P187  1  0.696705  1.020229  0.454775  1
  P  P188  1  0.196705  1.020229  0.454775  1
  P  P189  1  0.865980  0.348367  0.442221  1
  P  P190  1  0.777720  0.691849  0.467296  1
  P  P191  1  0.365980  0.348367  0.442221  1
  P  P192  1  0.277720  0.691849  0.467296  1
  P  P193  1  0.253081  0.801731  0.530481  1
  P  P194  1  0.753081  0.801731  0.530481  1
  P  P195  1  0.422356  1.129869  0.517927  1
  P  P196  1  0.341340  0.458248  0.505406  1
  P  P197  1  0.922356  1.129869  0.517927  1
  P  P198  1  0.841340  0.458248  0.505406  1
  P  P199  1  0.319303  1.044084  0.511705  1
  P  P200  1  0.819303  1.044084  0.511705  1
  P  P201  1  0.488714  0.372233  0.498922  1
  P  P202  1  0.400373  0.715724  0.524156  1
  P  P203  1  -0.011286  0.372233  0.498922  1
  P  P204  1  0.900373  0.715724  0.524156  1
  P  P205  1  0.716340  0.958248  0.505406  1
  P  P206  1  0.216340  0.958248  0.505406  1
  P  P207  1  0.628081  0.301731  0.530481  1
  P  P208  1  0.547356  0.629869  0.517927  1
  P  P209  1  0.128081  0.301731  0.530481  1
  P  P210  1  0.047356  0.629869  0.517927  1
  P  P211  1  0.613714  0.872233  0.498922  1
  P  P212  1  0.113714  0.872233  0.498922  1
  P  P213  1  0.525373  0.215724  0.524156  1
  P  P214  1  0.694303  0.544084  0.511705  1
  P  P215  1  0.025373  0.215724  0.524156  1
  P  P216  1  0.194303  0.544084  0.511705  1
  P  P217  1  0.466340  0.958248  0.505406  1
  P  P218  1  0.966340  0.958248  0.505406  1
  P  P219  1  0.378081  0.301731  0.530481  1
  P  P220  1  0.297356  0.629869  0.517927  1
  P  P221  1  0.878081  0.301731  0.530481  1
  P  P222  1  0.797356  0.629869  0.517927  1
  P  P223  1  0.363714  0.872233  0.498922  1
  P  P224  1  0.863714  0.872233  0.498922  1
  P  P225  1  0.275373  0.215724  0.524156  1
  P  P226  1  0.444303  0.544084  0.511705  1
  P  P227  1  0.775373  0.215724  0.524156  1
  P  P228  1  0.944303  0.544084  0.511705  1
  P  P229  1  0.503081  0.801731  0.530481  1
  P  P230  1  0.003081  0.801731  0.530481  1
  P  P231  1  0.672356  1.129869  0.517927  1
  P  P232  1  0.591340  0.458248  0.505406  1
  P  P233  1  0.172356  1.129869  0.517927  1
  P  P234  1  0.091340  0.458248  0.505406  1
  P  P235  1  0.569303  1.044084  0.511705  1
  P  P236  1  0.069303  1.044084  0.511705  1
  P  P237  1  0.738714  0.372233  0.498922  1
  P  P238  1  0.650373  0.715724  0.524156  1
  P  P239  1  0.238714  0.372233  0.498922  1
  P  P240  1  0.150373  0.715724  0.524156  1
  P  P241  1  0.125829  0.825520  0.587024  1
  P  P242  1  0.625829  0.825520  0.587024  1
  P  P243  1  0.294908  0.153774  0.574817  1
  P  P244  1  0.214088  0.482152  0.562338  1
  P  P245  1  0.794908  0.153774  0.574817  1
  P  P246  1  0.714088  0.482152  0.562338  1
  P  P247  1  0.191981  1.067947  0.568652  1
  P  P248  1  0.691981  1.067947  0.568652  1
  P  P249  1  0.361349  0.396175  0.555745  1
  P  P250  1  0.272922  0.739610  0.580950  1
  P  P251  1  0.861349  0.396175  0.555745  1
  P  P252  1  0.772922  0.739610  0.580950  1
  P  P253  1  0.589088  0.982152  0.562338  1
  P  P254  1  0.089088  0.982152  0.562338  1
  P  P255  1  0.500829  0.325520  0.587024  1
  P  P256  1  0.419908  0.653774  0.574817  1
  P  P257  1  0.000829  0.325520  0.587024  1
  P  P258  1  0.919908  0.653774  0.574817  1
  P  P259  1  0.486349  0.896175  0.555745  1
  P  P260  1  -0.013651  0.896175  0.555745  1
  P  P261  1  0.397922  0.239610  0.580950  1
  P  P262  1  0.566981  0.567947  0.568652  1
  P  P263  1  0.897922  0.239610  0.580950  1
  P  P264  1  0.066981  0.567947  0.568652  1
  P  P265  1  0.339088  0.982152  0.562338  1
  P  P266  1  0.839088  0.982152  0.562338  1
  P  P267  1  0.250829  0.325520  0.587024  1
  P  P268  1  0.169908  0.653774  0.574817  1
  P  P269  1  0.750829  0.325520  0.587024  1
  P  P270  1  0.669908  0.653774  0.574817  1
  P  P271  1  0.236349  0.896175  0.555745  1
  P  P272  1  0.736349  0.896175  0.555745  1
  P  P273  1  0.147922  0.239610  0.580950  1
  P  P274  1  0.316981  0.567947  0.568652  1
  P  P275  1  0.647922  0.239610  0.580950  1
  P  P276  1  0.816981  0.567947  0.568652  1
  P  P277  1  0.375829  0.825520  0.587024  1
  P  P278  1  0.875829  0.825520  0.587024  1
  P  P279  1  0.544908  0.153774  0.574817  1
  P  P280  1  0.464088  0.482152  0.562338  1
  P  P281  1  0.044908  0.153774  0.574817  1
  P  P282  1  0.964088  0.482152  0.562338  1
  P  P283  1  0.441981  1.067947  0.568652  1
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