# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   97.59791158
_cell_length_b   44.70486316
_cell_length_c   55.69045974
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   82.69392052
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P1152
_cell_volume   241010.325348
_cell_formula_units_Z   1152
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  0.087017  0.260982  0.350393  1
  P  P2  1  0.253452  0.323243  0.294798  1
  P  P3  1  0.086785  0.823243  0.294798  1
  P  P4  1  0.420351  0.260982  0.350393  1
  P  P5  1  0.586785  0.323243  0.294798  1
  P  P6  1  0.253684  0.760982  0.350393  1
  P  P7  1  0.420118  0.823243  0.294798  1
  P  P8  1  0.753684  0.260982  0.350393  1
  P  P9  1  0.920118  0.323243  0.294798  1
  P  P10  1  0.587017  0.760982  0.350393  1
  P  P11  1  0.753452  0.823243  0.294798  1
  P  P12  1  0.920351  0.760982  0.350393  1
  P  P13  1  0.086241  0.483388  0.316708  1
  P  P14  1  0.253248  0.420191  0.372264  1
  P  P15  1  0.086581  0.920191  0.372264  1
  P  P16  1  0.419575  0.483388  0.316708  1
  P  P17  1  0.586581  0.420191  0.372264  1
  P  P18  1  0.252908  0.983388  0.316708  1
  P  P19  1  0.419915  0.920191  0.372264  1
  P  P20  1  0.752908  0.483388  0.316708  1
  P  P21  1  0.919915  0.420191  0.372264  1
  P  P22  1  0.586241  0.983388  0.316708  1
  P  P23  1  0.753248  0.920191  0.372264  1
  P  P24  1  0.919575  0.983388  0.316708  1
  P  P25  1  0.078585  0.195527  0.351397  1
  P  P26  1  0.245214  0.259304  0.295781  1
  P  P27  1  0.078548  0.759304  0.295781  1
  P  P28  1  0.411918  0.195527  0.351397  1
  P  P29  1  0.578548  0.259304  0.295781  1
  P  P30  1  0.245251  0.695527  0.351397  1
  P  P31  1  0.411881  0.759304  0.295781  1
  P  P32  1  0.745251  0.195527  0.351397  1
  P  P33  1  0.911881  0.259304  0.295781  1
  P  P34  1  0.578585  0.695527  0.351397  1
  P  P35  1  0.745214  0.759304  0.295781  1
  P  P36  1  0.911918  0.695527  0.351397  1
  P  P37  1  0.094674  0.548844  0.315704  1
  P  P38  1  0.261681  0.485646  0.371260  1
  P  P39  1  0.095014  0.985646  0.371260  1
  P  P40  1  0.428007  0.548844  0.315704  1
  P  P41  1  0.595014  0.485646  0.371260  1
  P  P42  1  0.261341  0.048844  0.315704  1
  P  P43  1  0.428348  0.985646  0.371260  1
  P  P44  1  0.761341  0.548844  0.315704  1
  P  P45  1  0.928348  0.485646  0.371260  1
  P  P46  1  0.594674  0.048844  0.315704  1
  P  P47  1  0.761681  0.985646  0.371260  1
  P  P48  1  0.928007  0.048844  0.315704  1
  P  P49  1  0.109669  0.204978  0.344501  1
  P  P50  1  0.275577  0.268536  0.289030  1
  P  P51  1  0.108911  0.768536  0.289030  1
  P  P52  1  0.443002  0.204978  0.344501  1
  P  P53  1  0.608911  0.268536  0.289030  1
  P  P54  1  0.276335  0.704978  0.344501  1
  P  P55  1  0.442244  0.768536  0.289030  1
  P  P56  1  0.776335  0.204978  0.344501  1
  P  P57  1  0.942244  0.268536  0.289030  1
  P  P58  1  0.609669  0.704978  0.344501  1
  P  P59  1  0.775577  0.768536  0.289030  1
  P  P60  1  0.943002  0.704978  0.344501  1
  P  P61  1  0.063590  0.539393  0.322600  1
  P  P62  1  0.230597  0.476195  0.378155  1
  P  P63  1  0.063930  0.976195  0.378155  1
  P  P64  1  0.396924  0.539393  0.322600  1
  P  P65  1  0.563930  0.476195  0.378155  1
  P  P66  1  0.230257  0.039393  0.322600  1
  P  P67  1  0.397264  0.976195  0.378155  1
  P  P68  1  0.730257  0.539393  0.322600  1
  P  P69  1  0.897264  0.476195  0.378155  1
  P  P70  1  0.563590  0.039393  0.322600  1
  P  P71  1  0.730597  0.976195  0.378155  1
  P  P72  1  0.896924  0.039393  0.322600  1
  P  P73  1  0.088286  0.222435  0.303140  1
  P  P74  1  0.255293  0.159238  0.358696  1
  P  P75  1  0.088626  0.659238  0.358696  1
  P  P76  1  0.421620  0.222435  0.303140  1
  P  P77  1  0.588626  0.159238  0.358696  1
  P  P78  1  0.254953  0.722435  0.303140  1
  P  P79  1  0.421960  0.659238  0.358696  1
  P  P80  1  0.754953  0.222435  0.303140  1
  P  P81  1  0.921960  0.159238  0.358696  1
  P  P82  1  0.588286  0.722435  0.303140  1
  P  P83  1  0.755293  0.659238  0.358696  1
  P  P84  1  0.921620  0.722435  0.303140  1
  P  P85  1  0.084972  0.521936  0.363961  1
  P  P86  1  0.251292  0.585137  0.308390  1
  P  P87  1  0.084625  0.085137  0.308390  1
  P  P88  1  0.418306  0.521936  0.363961  1
  P  P89  1  0.584625  0.585137  0.308390  1
  P  P90  1  0.251639  0.021936  0.363961  1
  P  P91  1  0.417959  0.085137  0.308390  1
  P  P92  1  0.751639  0.521936  0.363961  1
  P  P93  1  0.917959  0.585137  0.308390  1
  P  P94  1  0.584972  0.021936  0.363961  1
  P  P95  1  0.751292  0.085137  0.308390  1
  P  P96  1  0.918306  0.021936  0.363961  1
  P  P97  1  0.148226  0.364926  0.314731  1
  P  P98  1  0.315233  0.301728  0.370287  1
  P  P99  1  0.148566  0.801728  0.370287  1
  P  P100  1  0.481559  0.364926  0.314731  1
  P  P101  1  0.648566  0.301728  0.370287  1
  P  P102  1  0.314892  0.864926  0.314731  1
  P  P103  1  0.481899  0.801728  0.370287  1
  P  P104  1  0.814892  0.364926  0.314731  1
  P  P105  1  0.981899  0.301728  0.370287  1
  P  P106  1  0.648226  0.864926  0.314731  1
  P  P107  1  0.815233  0.801728  0.370287  1
  P  P108  1  0.981559  0.864926  0.314731  1
  P  P109  1  0.025033  0.379445  0.352370  1
  P  P110  1  0.191680  0.443152  0.296674  1
  P  P111  1  0.025013  0.943152  0.296674  1
  P  P112  1  0.358366  0.379445  0.352370  1
  P  P113  1  0.525013  0.443152  0.296674  1
  P  P114  1  0.191700  0.879445  0.352370  1
  P  P115  1  0.358347  0.943152  0.296674  1
  P  P116  1  0.691700  0.379445  0.352370  1
  P  P117  1  0.858347  0.443152  0.296674  1
  P  P118  1  0.525033  0.879445  0.352370  1
  P  P119  1  0.691680  0.943152  0.296674  1
  P  P120  1  0.858366  0.879445  0.352370  1
  P  P121  1  0.117138  0.361740  0.327674  1
  P  P122  1  0.284145  0.298543  0.383230  1
  P  P123  1  0.117478  0.798543  0.383230  1
  P  P124  1  0.450471  0.361740  0.327674  1
  P  P125  1  0.617478  0.298543  0.383230  1
  P  P126  1  0.283805  0.861740  0.327674  1
  P  P127  1  0.450812  0.798543  0.383230  1
  P  P128  1  0.783805  0.361740  0.327674  1
  P  P129  1  0.950812  0.298543  0.383230  1
  P  P130  1  0.617138  0.861740  0.327674  1
  P  P131  1  0.784145  0.798543  0.383230  1
  P  P132  1  0.950471  0.861740  0.327674  1
  P  P133  1  0.056121  0.382631  0.339427  1
  P  P134  1  0.222044  0.446264  0.284004  1
  P  P135  1  0.055377  0.946264  0.284004  1
  P  P136  1  0.389454  0.382631  0.339427  1
  P  P137  1  0.555377  0.446264  0.284004  1
  P  P138  1  0.222787  0.882631  0.339427  1
  P  P139  1  0.388711  0.946264  0.284004  1
  P  P140  1  0.722787  0.382631  0.339427  1
  P  P141  1  0.888711  0.446264  0.284004  1
  P  P142  1  0.556121  0.882631  0.339427  1
  P  P143  1  0.722044  0.946264  0.284004  1
  P  P144  1  0.889454  0.882631  0.339427  1
  P  P145  1  0.137518  0.302083  0.321057  1
  P  P146  1  0.304525  0.238886  0.376613  1
  P  P147  1  0.137858  0.738886  0.376613  1
  P  P148  1  0.470851  0.302083  0.321057  1
  P  P149  1  0.637858  0.238886  0.376613  1
  P  P150  1  0.304185  0.802083  0.321057  1
  P  P151  1  0.471191  0.738886  0.376613  1
  P  P152  1  0.804185  0.302083  0.321057  1
  P  P153  1  0.971191  0.238886  0.376613  1
  P  P154  1  0.637518  0.802083  0.321057  1
  P  P155  1  0.804525  0.738886  0.376613  1
  P  P156  1  0.970851  0.802083  0.321057  1
  P  P157  1  0.035741  0.442288  0.346044  1
  P  P158  1  0.202138  0.504539  0.290481  1
  P  P159  1  0.035471  0.004539  0.290481  1
  P  P160  1  0.369074  0.442288  0.346044  1
  P  P161  1  0.535471  0.504539  0.290481  1
  P  P162  1  0.202407  0.942288  0.346044  1
  P  P163  1  0.368805  0.004539  0.290481  1
  P  P164  1  0.702407  0.442288  0.346044  1
  P  P165  1  0.868805  0.504539  0.290481  1
  P  P166  1  0.535741  0.942288  0.346044  1
  P  P167  1  0.702138  0.004539  0.290481  1
  P  P168  1  0.869074  0.942288  0.346044  1
  P  P169  1  0.140296  0.343353  0.365951  1
  P  P170  1  0.306611  0.406549  0.310381  1
  P  P171  1  0.139944  0.906549  0.310381  1
  P  P172  1  0.473629  0.343353  0.365951  1
  P  P173  1  0.639944  0.406549  0.310381  1
  P  P174  1  0.306963  0.843353  0.365951  1
  P  P175  1  0.473277  0.906549  0.310381  1
  P  P176  1  0.806963  0.343353  0.365951  1
  P  P177  1  0.973277  0.406549  0.310381  1
  P  P178  1  0.640296  0.843353  0.365951  1
  P  P179  1  0.806611  0.906549  0.310381  1
  P  P180  1  0.973629  0.843353  0.365951  1
  P  P181  1  0.032963  0.401018  0.301150  1
  P  P182  1  0.199969  0.337821  0.356705  1
  P  P183  1  0.033303  0.837821  0.356705  1
  P  P184  1  0.366296  0.401018  0.301150  1
  P  P185  1  0.533303  0.337821  0.356705  1
  P  P186  1  0.199629  0.901018  0.301150  1
  P  P187  1  0.366636  0.837821  0.356705  1
  P  P188  1  0.699629  0.401018  0.301150  1
  P  P189  1  0.866636  0.337821  0.356705  1
  P  P190  1  0.532963  0.901018  0.301150  1
  P  P191  1  0.699969  0.837821  0.356705  1
  P  P192  1  0.866296  0.901018  0.301150  1
  P  P193  1  0.034256  0.095844  0.371725  1
  P  P194  1  0.200583  0.159041  0.316169  1
  P  P195  1  0.033916  0.659041  0.316169  1
  P  P196  1  0.367590  0.095844  0.371725  1
  P  P197  1  0.533916  0.159041  0.316169  1
  P  P198  1  0.200923  0.595844  0.371725  1
  P  P199  1  0.367250  0.659041  0.316169  1
  P  P200  1  0.700923  0.095844  0.371725  1
  P  P201  1  0.867250  0.159041  0.316169  1
  P  P202  1  0.534256  0.595844  0.371725  1
  P  P203  1  0.700583  0.659041  0.316169  1
  P  P204  1  0.867590  0.595844  0.371725  1
  P  P205  1  0.139028  0.648478  0.295364  1
  P  P206  1  0.306009  0.585329  0.350932  1
  P  P207  1  0.139342  0.085329  0.350932  1
  P  P208  1  0.472361  0.648478  0.295364  1
  P  P209  1  0.639342  0.585329  0.350932  1
  P  P210  1  0.305695  0.148478  0.295364  1
  P  P211  1  0.472676  0.085329  0.350932  1
  P  P212  1  0.805695  0.648478  0.295364  1
  P  P213  1  0.972676  0.585329  0.350932  1
  P  P214  1  0.639028  0.148478  0.295364  1
  P  P215  1  0.806009  0.085329  0.350932  1
  P  P216  1  0.972361  0.148478  0.295364  1
  P  P217  1  0.024294  0.211798  0.313165  1
  P  P218  1  0.191385  0.147786  0.369077  1
  P  P219  1  0.024719  0.647786  0.369077  1
  P  P220  1  0.357627  0.211798  0.313165  1
  P  P221  1  0.524719  0.147786  0.369077  1
  P  P222  1  0.190960  0.711798  0.313165  1
  P  P223  1  0.358052  0.647786  0.369077  1
  P  P224  1  0.690960  0.211798  0.313165  1
  P  P225  1  0.858052  0.147786  0.369077  1
  P  P226  1  0.524294  0.711798  0.313165  1
  P  P227  1  0.691385  0.647786  0.369077  1
  P  P228  1  0.857627  0.711798  0.313165  1
  P  P229  1  0.148880  0.533388  0.353579  1
  P  P230  1  0.315207  0.596585  0.298024  1
  P  P231  1  0.148540  0.096585  0.298024  1
  P  P232  1  0.482213  0.533388  0.353579  1
  P  P233  1  0.648540  0.596585  0.298024  1
  P  P234  1  0.315547  0.033388  0.353579  1
  P  P235  1  0.481873  0.096585  0.298024  1
  P  P236  1  0.815547  0.533388  0.353579  1
  P  P237  1  0.981873  0.596585  0.298024  1
  P  P238  1  0.648880  0.033388  0.353579  1
  P  P239  1  0.815207  0.096585  0.298024  1
  P  P240  1  0.982213  0.033388  0.353579  1
  P  P241  1  0.005421  0.253476  0.279993  1
  P  P242  1  0.172048  0.190484  0.335167  1
  P  P243  1  0.005381  0.690484  0.335167  1
  P  P244  1  0.338754  0.253476  0.279993  1
  P  P245  1  0.505381  0.190484  0.335167  1
  P  P246  1  0.172087  0.753476  0.279993  1
  P  P247  1  0.338715  0.690484  0.335167  1
  P  P248  1  0.672087  0.253476  0.279993  1
  P  P249  1  0.838715  0.190484  0.335167  1
  P  P250  1  0.505421  0.753476  0.279993  1
  P  P251  1  0.672048  0.690484  0.335167  1
  P  P252  1  0.838754  0.753476  0.279993  1
  P  P253  1  0.168217  0.490690  0.387489  1
  P  P254  1  0.334544  0.553887  0.331934  1
  P  P255  1  0.167877  0.053887  0.331934  1
  P  P256  1  0.501551  0.490690  0.387489  1
  P  P257  1  0.667877  0.553887  0.331934  1
  P  P258  1  0.334884  0.990690  0.387489  1
  P  P259  1  0.501211  0.053887  0.331934  1
  P  P260  1  0.834884  0.490690  0.387489  1
  P  P261  1  1.001211  0.553887  0.331934  1
  P  P262  1  0.668217  0.990690  0.387489  1
  P  P263  1  0.834544  0.053887  0.331934  1
  P  P264  1  0.001551  0.990690  0.387489  1
  P  P265  1  0.032367  0.273426  0.298790  1
  P  P266  1  0.199643  0.210888  0.354382  1
  P  P267  1  0.032976  0.710888  0.354382  1
  P  P268  1  0.365701  0.273426  0.298790  1
  P  P269  1  0.532976  0.210888  0.354382  1
  P  P270  1  0.199034  0.773426  0.298790  1
  P  P271  1  0.366310  0.710888  0.354382  1
  P  P272  1  0.699034  0.273426  0.298790  1
  P  P273  1  0.866310  0.210888  0.354382  1
  P  P274  1  0.532367  0.773426  0.298790  1
  P  P275  1  0.699643  0.710888  0.354382  1
  P  P276  1  0.865701  0.773426  0.298790  1
  P  P277  1  0.140623  0.470285  0.368274  1
  P  P278  1  0.306949  0.533482  0.312718  1
  P  P279  1  0.140282  0.033482  0.312718  1
  P  P280  1  0.473956  0.470285  0.368274  1
  P  P281  1  0.640282  0.533482  0.312718  1
  P  P282  1  0.307289  0.970285  0.368274  1
  P  P283  1  0.473616  0.033482  0.312718  1
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