# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   48.62589600
_cell_length_b   19.76923300
_cell_length_c   48.85191100
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   85.39553710
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P216
_cell_volume   46809.6180869
_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  0.194964  0.633986  0.416135  1
  P  P2  1  0.522517  0.788460  0.320956  1
  P  P3  1  0.858632  0.712273  0.368516  1
  P  P4  1  0.189450  0.116394  0.346579  1
  P  P5  1  0.525782  0.038107  0.394198  1
  P  P6  1  0.853119  0.194681  0.298960  1
  P  P7  1  0.178813  0.486118  0.427799  1
  P  P8  1  0.506744  0.644023  0.332374  1
  P  P9  1  0.842481  0.564405  0.380180  1
  P  P10  1  0.205602  0.264262  0.334914  1
  P  P11  1  0.541933  0.185975  0.382533  1
  P  P12  1  0.869270  0.342549  0.287295  1
  P  P13  1  0.240244  0.511592  0.414265  1
  P  P14  1  0.566747  0.668899  0.319124  1
  P  P15  1  0.903912  0.589879  0.366646  1
  P  P16  1  0.144170  0.238788  0.348448  1
  P  P17  1  0.480502  0.160501  0.396068  1
  P  P18  1  0.807838  0.317075  0.300829  1
  P  P19  1  0.195064  0.527884  0.368315  1
  P  P20  1  0.531396  0.449597  0.415934  1
  P  P21  1  0.858733  0.606171  0.320696  1
  P  P22  1  0.189350  0.222496  0.394399  1
  P  P23  1  0.516663  0.379035  0.299130  1
  P  P24  1  0.853018  0.300783  0.346780  1
  P  P25  1  0.313820  0.865387  0.352442  1
  P  P26  1  0.650152  0.787100  0.400061  1
  P  P27  1  0.977489  0.943674  0.304823  1
  P  P28  1  0.070594  0.884993  0.410272  1
  P  P29  1  0.398556  0.042714  0.314763  1
  P  P30  1  0.734262  0.963280  0.362653  1
  P  P31  1  0.252680  0.856506  0.371884  1
  P  P32  1  0.589011  0.778219  0.419503  1
  P  P33  1  0.916348  0.934793  0.324265  1
  P  P34  1  0.131734  0.893874  0.390830  1
  P  P35  1  0.458269  0.051371  0.295731  1
  P  P36  1  0.795403  0.972161  0.343211  1
  P  P37  1  0.293426  0.725104  0.370043  1
  P  P38  1  0.629757  0.646817  0.417662  1
  P  P39  1  0.957094  0.803391  0.322424  1
  P  P40  1  0.090988  0.025276  0.392671  1
  P  P41  1  0.418468  0.179733  0.297535  1
  P  P42  1  0.754657  0.103563  0.345052  1
  P  P43  1  0.301224  0.837232  0.414246  1
  P  P44  1  0.628526  0.993758  0.318978  1
  P  P45  1  0.964892  0.915519  0.366627  1
  P  P46  1  0.083190  0.913148  0.348468  1
  P  P47  1  0.419522  0.834861  0.396087  1
  P  P48  1  0.746859  0.991435  0.300849  1
  P  P49  1  0.083663  0.496431  0.328356  1
  P  P50  1  0.419995  0.418144  0.375975  1
  P  P51  1  0.756326  0.339856  0.423594  1
  P  P52  1  0.291813  0.488663  0.291477  1
  P  P53  1  0.628520  0.408958  0.338701  1
  P  P54  1  0.964419  0.332236  0.386739  1
  P  P55  1  0.068548  0.491763  0.390767  1
  P  P56  1  0.395876  0.648498  0.295503  1
  P  P57  1  0.732019  0.571692  0.342642  1
  P  P58  1  0.315866  0.258617  0.371946  1
  P  P59  1  0.652198  0.180330  0.419566  1
  P  P60  1  0.979535  0.336904  0.324327  1
  P  P61  1  0.027652  0.568149  0.349305  1
  P  P62  1  0.363984  0.489862  0.396924  1
  P  P63  1  0.692101  0.646221  0.302087  1
  P  P64  1  0.356762  0.182231  0.413409  1
  P  P65  1  0.683232  0.338953  0.318206  1
  P  P66  1  0.020430  0.260518  0.365790  1
  P  P67  1  0.083568  0.628469  0.364068  1
  P  P68  1  0.419899  0.550182  0.411688  1
  P  P69  1  0.746709  0.705181  0.316530  1
  P  P70  1  0.300846  0.121910  0.398645  1
  P  P71  1  0.628609  0.280064  0.303764  1
  P  P72  1  0.964515  0.200198  0.351026  1
  P  P73  1  0.203959  0.399124  0.558992  1
  P  P74  1  0.531296  0.555699  0.463754  1
  P  P75  1  0.867627  0.477411  0.511373  1
  P  P76  1  0.198445  0.881533  0.489436  1
  P  P77  1  0.534777  0.803246  0.537055  1
  P  P78  1  0.862113  0.959820  0.441817  1
  P  P79  1  0.187807  0.251256  0.570657  1
  P  P80  1  0.515144  0.407830  0.475418  1
  P  P81  1  0.851476  0.329543  0.523038  1
  P  P82  1  0.214596  0.029401  0.477772  1
  P  P83  1  0.550928  0.951114  0.525391  1
  P  P84  1  0.878265  0.107688  0.430152  1
  P  P85  1  0.249239  0.276731  0.557122  1
  P  P86  1  0.576576  0.433305  0.461884  1
  P  P87  1  0.912907  0.355018  0.509503  1
  P  P88  1  0.153165  0.003926  0.491306  1
  P  P89  1  0.489496  0.925639  0.538925  1
  P  P90  1  0.816833  0.082214  0.443687  1
  P  P91  1  0.204059  0.293022  0.511172  1
  P  P92  1  0.540391  0.214735  0.558791  1
  P  P93  1  0.867728  0.371309  0.463553  1
  P  P94  1  0.198344  0.987635  0.537256  1
  P  P95  1  0.525681  0.144209  0.442018  1
  P  P96  1  0.862013  0.065922  0.489637  1
  P  P97  1  0.322815  0.630526  0.495299  1
  P  P98  1  0.659147  0.552238  0.542918  1
  P  P99  1  0.986483  0.708813  0.447680  1
  P  P100  1  0.079589  0.650132  0.553129  1
  P  P101  1  0.406926  0.806706  0.457891  1
  P  P102  1  0.743257  0.728419  0.505510  1
  P  P103  1  0.261675  0.621645  0.514741  1
  P  P104  1  0.598006  0.543358  0.562360  1
  P  P105  1  0.925343  0.699932  0.467122  1
  P  P106  1  0.140729  0.659012  0.533687  1
  P  P107  1  0.468066  0.815587  0.438449  1
  P  P108  1  0.804398  0.737300  0.486068  1
  P  P109  1  0.302420  0.490243  0.512900  1
  P  P110  1  0.638752  0.411955  0.560519  1
  P  P111  1  0.966089  0.568530  0.465281  1
  P  P112  1  0.099983  0.790415  0.535528  1
  P  P113  1  0.427320  0.946989  0.440290  1
  P  P114  1  0.763652  0.868702  0.487909  1
  P  P115  1  0.310219  0.602370  0.557103  1
  P  P116  1  0.637556  0.758945  0.461865  1
  P  P117  1  0.973887  0.680658  0.509484  1
  P  P118  1  0.092185  0.678287  0.491325  1
  P  P119  1  0.428517  0.600000  0.538944  1
  P  P120  1  0.755853  0.756574  0.443706  1
  P  P121  1  0.092658  0.261569  0.471213  1
  P  P122  1  0.428990  0.183282  0.518832  1
  P  P123  1  0.765321  0.104995  0.566451  1
  P  P124  1  0.300751  0.253949  0.434358  1
  P  P125  1  0.637083  0.175662  0.481977  1
  P  P126  1  0.973414  0.097375  0.529596  1
  P  P127  1  0.077543  0.256901  0.533624  1
  P  P128  1  0.404879  0.413476  0.438386  1
  P  P129  1  0.741211  0.335189  0.486005  1
  P  P130  1  0.324861  0.023756  0.514804  1
  P  P131  1  0.661193  0.945469  0.562423  1
  P  P132  1  0.988530  0.102043  0.467185  1
  P  P133  1  0.036647  0.333287  0.492162  1
  P  P134  1  0.372978  0.255000  0.539781  1
  P  P135  1  0.700315  0.411574  0.444543  1
  P  P136  1  0.365757  0.947370  0.556266  1
  P  P137  1  0.693094  0.103944  0.461028  1
  P  P138  1  0.029425  0.025657  0.508647  1
  P  P139  1  0.092563  0.393608  0.506926  1
  P  P140  1  0.428894  0.315321  0.554545  1
  P  P141  1  0.756231  0.471895  0.459307  1
  P  P142  1  0.309841  0.887049  0.541502  1
  P  P143  1  0.637178  0.043623  0.446264  1
  P  P144  1  0.973510  0.965336  0.493883  1
  P  P145  1  0.212954  0.164263  0.701849  1
  P  P146  1  0.540290  0.320837  0.606611  1
  P  P147  1  0.876622  0.242550  0.654230  1
  P  P148  1  0.207440  0.646672  0.632293  1
  P  P149  1  0.543556  0.570484  0.679853  1
  P  P150  1  0.871108  0.724959  0.584674  1
  P  P151  1  0.196802  0.016395  0.713514  1
  P  P152  1  0.524139  0.172969  0.618276  1
  P  P153  1  0.860471  0.094682  0.665895  1
  P  P154  1  0.223591  0.794540  0.620629  1
  P  P155  1  0.559328  0.714921  0.668435  1
  P  P156  1  0.887260  0.872827  0.573010  1
  P  P157  1  0.258234  0.041870  0.699980  1
  P  P158  1  0.585571  0.198444  0.604741  1
  P  P159  1  0.921902  0.120157  0.652361  1
  P  P160  1  0.162160  0.769065  0.634163  1
  P  P161  1  0.499325  0.690045  0.681685  1
  P  P162  1  0.825828  0.847352  0.586544  1
  P  P163  1  0.213054  0.058161  0.654029  1
  P  P164  1  0.549409  0.979909  0.701679  1
  P  P165  1  0.876723  0.136448  0.606410  1
  P  P166  1  0.207339  0.752774  0.680113  1
  P  P167  1  0.534676  0.909348  0.584875  1
  P  P168  1  0.871008  0.831061  0.632494  1
  P  P169  1  0.331810  0.395664  0.638156  1
  P  P170  1  0.667517  0.316231  0.686046  1
  P  P171  1  0.995478  0.473951  0.590537  1
  P  P172  1  0.088584  0.415270  0.695986  1
  P  P173  1  0.415920  0.571845  0.600748  1
  P  P174  1  0.752252  0.493558  0.648367  1
  P  P175  1  0.270669  0.386783  0.657598  1
  P  P176  1  0.607804  0.307573  0.705078  1
  P  P177  1  0.934338  0.465071  0.609979  1
  P  P178  1  0.149724  0.424151  0.676544  1
  P  P179  1  0.477061  0.580725  0.581306  1
  P  P180  1  0.813393  0.502438  0.628925  1
  P  P181  1  0.311415  0.255381  0.655757  1
  P  P182  1  0.647604  0.179211  0.703274  1
  P  P183  1  0.975084  0.333668  0.608138  1
  P  P184  1  0.108978  0.555553  0.678385  1
  P  P185  1  0.436315  0.712128  0.583147  1
  P  P186  1  0.772647  0.633841  0.630766  1
  P  P187  1  0.319214  0.367509  0.699960  1
  P  P188  1  0.646550  0.524083  0.604722  1
  P  P189  1  0.982882  0.445796  0.652341  1
  P  P190  1  0.101180  0.443425  0.634182  1
  P  P191  1  0.437547  0.365186  0.681831  1
  P  P192  1  0.764848  0.521713  0.586563  1
  P  P193  1  0.101653  0.026708  0.614070  1
  P  P194  1  0.437552  0.949986  0.662108  1
  P  P195  1  0.774259  0.870282  0.709333  1
  P  P196  1  0.309746  0.019088  0.577215  1
  P  P197  1  0.646078  0.940801  0.624834  1
  P  P198  1  0.982409  0.862514  0.672453  1
  P  P199  1  0.086538  0.022040  0.676482  1
  P  P200  1  0.413874  0.178614  0.581244  1
  P  P201  1  0.750206  0.100327  0.628863  1
  P  P202  1  0.334054  0.787252  0.658167  1
  P  P203  1  0.670196  0.710446  0.705306  1
  P  P204  1  0.997524  0.867182  0.610042  1
  P  P205  1  0.045642  0.098426  0.635019  1
  P  P206  1  0.382840  0.019992  0.682603  1
  P  P207  1  0.709310  0.176713  0.587400  1
  P  P208  1  0.373971  0.712724  0.698722  1
  P  P209  1  0.702089  0.869083  0.603885  1
  P  P210  1  0.038420  0.790796  0.651504  1
  P  P211  1  0.101557  0.158747  0.649783  1
  P  P212  1  0.437463  0.078881  0.697045  1
  P  P213  1  0.765226  0.237034  0.602164  1
  P  P214  1  0.319363  0.653763  0.684279  1
  P  P215  1  0.646173  0.808762  0.589121  1
  P  P216  1  0.982505  0.730475  0.636741  1
