# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   16.47279927
_cell_length_b   52.00989885
_cell_length_c   54.67618379
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   92.32883966
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P216
_cell_volume   46805.0554878
_cell_formula_units_Z   216
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  0.233703  0.087681  0.400851  1
  P  P2  1  0.298791  0.455485  0.305803  1
  P  P3  1  0.265790  0.771212  0.353232  1
  P  P4  1  0.256154  0.978594  0.362475  1
  P  P5  1  0.224067  0.295063  0.410094  1
  P  P6  1  0.287470  0.661372  0.315062  1
  P  P7  1  0.200814  0.139887  0.374538  1
  P  P8  1  0.168727  0.456356  0.422157  1
  P  P9  1  0.232901  0.823418  0.326919  1
  P  P10  1  0.289043  0.926388  0.388788  1
  P  P11  1  0.353054  0.293493  0.293512  1
  P  P12  1  0.319567  0.610387  0.340793  1
  P  P13  1  0.372277  0.130769  0.397264  1
  P  P14  1  0.434146  0.497578  0.302295  1
  P  P15  1  0.404363  0.814300  0.349645  1
  P  P16  1  0.117581  0.935506  0.366061  1
  P  P17  1  0.085494  0.251975  0.413680  1
  P  P18  1  0.152103  0.619283  0.318568  1
  P  P19  1  0.318693  0.188960  0.288663  1
  P  P20  1  0.287732  0.505022  0.335828  1
  P  P21  1  0.254419  0.821938  0.383944  1
  P  P22  1  0.267526  0.927868  0.331762  1
  P  P23  1  0.235439  0.244337  0.379381  1
  P  P24  1  0.203352  0.560806  0.427000  1
  P  P25  1  0.635633  0.063012  0.351322  1
  P  P26  1  0.603546  0.379481  0.398941  1
  P  P27  1  0.667559  0.746574  0.303662  1
  P  P28  1  0.854224  0.003263  0.412004  1
  P  P29  1  0.918398  0.370325  0.316766  1
  P  P30  1  0.886311  0.686794  0.364385  1
  P  P31  1  0.466233  0.064569  0.325176  1
  P  P32  1  0.434146  0.381038  0.372795  1
  P  P33  1  0.402059  0.697507  0.420414  1
  P  P34  1  0.117612  0.051999  0.295546  1
  P  P35  1  0.087798  0.368768  0.342912  1
  P  P36  1  0.055711  0.685237  0.390531  1
  P  P37  1  0.592233  0.111185  0.320062  1
  P  P38  1  0.560146  0.427654  0.367681  1
  P  P39  1  0.528059  0.744123  0.415300  1
  P  P40  1  0.994542  0.006460  0.300548  1
  P  P41  1  0.961798  0.322152  0.348026  1
  P  P42  1  0.929711  0.638621  0.395645  1
  P  P43  1  0.624750  0.058740  0.294133  1
  P  P44  1  0.592663  0.375209  0.341752  1
  P  P45  1  0.560576  0.691678  0.389371  1
  P  P46  1  0.962823  0.057681  0.325899  1
  P  P47  1  0.929281  0.374596  0.373954  1
  P  P48  1  0.897194  0.691065  0.421573  1
  P  P49  1  0.981586  0.215941  0.303820  1
  P  P50  1  0.949624  0.532478  0.351472  1
  P  P51  1  0.917537  0.848947  0.399091  1
  P  P52  1  0.604407  0.900858  0.316615  1
  P  P53  1  0.572320  0.217327  0.364234  1
  P  P54  1  0.540233  0.533796  0.411853  1
  P  P55  1  0.865982  0.152503  0.390878  1
  P  P56  1  0.930155  0.519565  0.295639  1
  P  P57  1  0.898068  0.836034  0.343258  1
  P  P58  1  0.623876  0.913772  0.372448  1
  P  P59  1  0.591789  0.230241  0.420067  1
  P  P60  1  0.656837  0.597759  0.324256  1
  P  P61  1  0.726349  0.136763  0.427674  1
  P  P62  1  0.790523  0.503825  0.332436  1
  P  P63  1  0.758436  0.820294  0.380055  1
  P  P64  1  0.763508  0.929511  0.335651  1
  P  P65  1  0.731421  0.245980  0.383270  1
  P  P66  1  0.793194  0.613111  0.288289  1
  P  P67  1  0.890495  0.108157  0.428791  1
  P  P68  1  0.954669  0.475219  0.333553  1
  P  P69  1  0.922582  0.791688  0.381172  1
  P  P70  1  0.599363  0.958117  0.334534  1
  P  P71  1  0.567276  0.274586  0.382153  1
  P  P72  1  0.632851  0.641055  0.287198  1
  P  P73  1  0.137442  0.037088  0.543708  1
  P  P74  1  0.201616  0.404150  0.448470  1
  P  P75  1  0.169529  0.720619  0.496089  1
  P  P76  1  0.159893  0.928001  0.505332  1
  P  P77  1  0.127806  0.244470  0.552951  1
  P  P78  1  0.191980  0.611532  0.457713  1
  P  P79  1  0.104553  0.089294  0.517395  1
  P  P80  1  0.072466  0.405763  0.565014  1
  P  P81  1  0.136640  0.772825  0.469776  1
  P  P82  1  0.192782  0.875795  0.531645  1
  P  P83  1  0.256956  0.242857  0.436407  1
  P  P84  1  0.224869  0.559326  0.484026  1
  P  P85  1  0.276016  0.080176  0.540121  1
  P  P86  1  0.340190  0.447238  0.444883  1
  P  P87  1  0.308103  0.763707  0.492502  1
  P  P88  1  0.021320  0.884913  0.508918  1
  P  P89  1  0.989233  0.201382  0.556537  1
  P  P90  1  0.053407  0.568444  0.461299  1
  P  P91  1  0.222332  0.138407  0.431563  1
  P  P92  1  0.190245  0.454876  0.479183  1
  P  P93  1  0.158158  0.771345  0.526802  1
  P  P94  1  0.171265  0.877275  0.474619  1
  P  P95  1  0.139178  0.193744  0.522238  1
  P  P96  1  0.107091  0.510213  0.569857  1
  P  P97  1  0.539372  0.012419  0.494179  1
  P  P98  1  0.507285  0.328888  0.541798  1
  P  P99  1  0.571459  0.695950  0.446560  1
  P  P100  1  0.757963  0.952670  0.554861  1
  P  P101  1  0.822137  0.319732  0.459623  1
  P  P102  1  0.790050  0.636201  0.507242  1
  P  P103  1  0.369972  0.013976  0.468033  1
  P  P104  1  0.337885  0.330445  0.515652  1
  P  P105  1  0.305798  0.646914  0.563271  1
  P  P106  1  0.023624  0.001706  0.438150  1
  P  P107  1  0.991537  0.318175  0.485769  1
  P  P108  1  0.959451  0.634644  0.533388  1
  P  P109  1  0.495972  0.060592  0.462919  1
  P  P110  1  0.463885  0.377061  0.510538  1
  P  P111  1  0.431798  0.693530  0.558157  1
  P  P112  1  0.897624  0.955090  0.443264  1
  P  P113  1  0.865537  0.271559  0.490883  1
  P  P114  1  0.833450  0.588028  0.538502  1
  P  P115  1  0.528489  0.008147  0.436990  1
  P  P116  1  0.496402  0.324616  0.484609  1
  P  P117  1  0.464315  0.641085  0.532228  1
  P  P118  1  0.865108  0.007534  0.469192  1
  P  P119  1  0.833021  0.324003  0.516811  1
  P  P120  1  0.800934  0.640472  0.564430  1
  P  P121  1  0.885450  0.165416  0.446710  1
  P  P122  1  0.853363  0.481885  0.494329  1
  P  P123  1  0.821276  0.798354  0.541948  1
  P  P124  1  0.508146  0.850265  0.459473  1
  P  P125  1  0.476059  0.166734  0.507092  1
  P  P126  1  0.443972  0.483203  0.554711  1
  P  P127  1  0.769721  0.101910  0.533735  1
  P  P128  1  0.833895  0.468972  0.438497  1
  P  P129  1  0.801808  0.785441  0.486116  1
  P  P130  1  0.527615  0.863179  0.515305  1
  P  P131  1  0.495528  0.179648  0.562924  1
  P  P132  1  0.559702  0.546710  0.467686  1
  P  P133  1  0.630088  0.086170  0.570531  1
  P  P134  1  0.694262  0.453232  0.475293  1
  P  P135  1  0.662175  0.769701  0.522912  1
  P  P136  1  0.667247  0.878918  0.478508  1
  P  P137  1  0.635160  0.195387  0.526128  1
  P  P138  1  0.699334  0.562449  0.430889  1
  P  P139  1  0.794234  0.057564  0.571649  1
  P  P140  1  0.858408  0.424626  0.476411  1
  P  P141  1  0.826321  0.741095  0.524030  1
  P  P142  1  0.503102  0.907524  0.477391  1
  P  P143  1  0.471015  0.223993  0.525010  1
  P  P144  1  0.535189  0.591055  0.429772  1
  P  P145  1  0.041952  0.987248  0.686358  1
  P  P146  1  0.105355  0.353557  0.591327  1
  P  P147  1  0.073268  0.670026  0.638946  1
  P  P148  1  0.063632  0.877408  0.648189  1
  P  P149  1  0.030631  0.193134  0.695617  1
  P  P150  1  0.095719  0.560939  0.600570  1
  P  P151  1  0.009855  0.038233  0.660628  1
  P  P152  1  0.976368  0.355127  0.707909  1
  P  P153  1  0.040379  0.722232  0.612633  1
  P  P154  1  0.096522  0.825202  0.674502  1
  P  P155  1  0.160695  0.192264  0.579264  1
  P  P156  1  0.128609  0.508733  0.626883  1
  P  P157  1  0.177320  0.029337  0.682853  1
  P  P158  1  0.243929  0.396645  0.587740  1
  P  P159  1  0.211842  0.713114  0.635359  1
  P  P160  1  0.925059  0.834320  0.651776  1
  P  P161  1  0.895276  0.151042  0.699125  1
  P  P162  1  0.957146  0.517851  0.604156  1
  P  P163  1  0.126071  0.087814  0.574421  1
  P  P164  1  0.093984  0.404283  0.622040  1
  P  P165  1  0.061897  0.720752  0.669659  1
  P  P166  1  0.075004  0.826682  0.617476  1
  P  P167  1  0.041690  0.143597  0.665593  1
  P  P168  1  0.010729  0.459659  0.712758  1
  P  P169  1  0.443111  0.961826  0.637036  1
  P  P170  1  0.411025  0.278295  0.684655  1
  P  P171  1  0.475198  0.645357  0.589417  1
  P  P172  1  0.661864  0.902046  0.697759  1
  P  P173  1  0.725876  0.269139  0.602480  1
  P  P174  1  0.693789  0.585608  0.650099  1
  P  P175  1  0.273711  0.963383  0.610890  1
  P  P176  1  0.241624  0.279852  0.658509  1
  P  P177  1  0.211810  0.596620  0.705875  1
  P  P178  1  0.927364  0.951113  0.581007  1
  P  P179  1  0.895277  0.267582  0.628626  1
  P  P180  1  0.863190  0.584051  0.676245  1
  P  P181  1  0.399711  0.009999  0.605776  1
  P  P182  1  0.367624  0.326468  0.653395  1
  P  P183  1  0.334881  0.642159  0.700873  1
  P  P184  1  0.801363  0.904497  0.586121  1
  P  P185  1  0.769276  0.220966  0.633740  1
  P  P186  1  0.737189  0.537435  0.681359  1
  P  P187  1  0.432228  0.957554  0.579848  1
  P  P188  1  0.400141  0.274023  0.627467  1
  P  P189  1  0.366599  0.590938  0.675521  1
  P  P190  1  0.768847  0.956941  0.612049  1
  P  P191  1  0.736760  0.273410  0.659668  1
  P  P192  1  0.704673  0.589879  0.707287  1
  P  P193  1  0.789189  0.114823  0.589567  1
  P  P194  1  0.757102  0.431292  0.637186  1
  P  P195  1  0.725015  0.747761  0.684805  1
  P  P196  1  0.411886  0.799672  0.602330  1
  P  P197  1  0.379799  0.116141  0.649949  1
  P  P198  1  0.347837  0.432679  0.697601  1
  P  P199  1  0.672586  0.050860  0.677165  1
  P  P200  1  0.737634  0.418379  0.581354  1
  P  P201  1  0.705547  0.734848  0.628973  1
  P  P202  1  0.431354  0.812586  0.658162  1
  P  P203  1  0.399267  0.129055  0.705781  1
  P  P204  1  0.463441  0.496117  0.610543  1
  P  P205  1  0.536228  0.035509  0.713132  1
  P  P206  1  0.598001  0.402639  0.618150  1
  P  P207  1  0.565914  0.719108  0.665769  1
  P  P208  1  0.570987  0.828325  0.621366  1
  P  P209  1  0.538900  0.144794  0.668985  1
  P  P210  1  0.603073  0.511856  0.573747  1
  P  P211  1  0.696571  0.007565  0.714222  1
  P  P212  1  0.762147  0.374033  0.619268  1
  P  P213  1  0.730060  0.690502  0.666887  1
  P  P214  1  0.406841  0.856931  0.620248  1
  P  P215  1  0.374754  0.173400  0.667867  1
  P  P216  1  0.438928  0.540462  0.572629  1
