# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   103.18981964
_cell_length_b   55.18636816
_cell_length_c   49.49540491
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   86.53088689
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P1296
_cell_volume   281343.574932
_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  0.863487  0.755069  0.314202  1
  P  P2  1  0.363487  0.755069  0.314202  1
  P  P3  1  0.521879  0.733712  0.361821  1
  P  P4  1  0.696820  0.421736  0.314202  1
  P  P5  1  0.680270  0.712354  0.409440  1
  P  P6  1  0.855212  0.400378  0.361821  1
  P  P7  1  0.021879  0.733712  0.361821  1
  P  P8  1  0.196820  0.421736  0.314202  1
  P  P9  1  0.180270  0.712354  0.409440  1
  P  P10  1  0.355212  0.400378  0.361821  1
  P  P11  1  0.530154  0.088402  0.314202  1
  P  P12  1  0.513604  0.379021  0.409440  1
  P  P13  1  0.688545  0.067045  0.361821  1
  P  P14  1  0.846937  0.045688  0.409440  1
  P  P15  1  0.030154  0.088402  0.314202  1
  P  P16  1  0.013604  0.379021  0.409440  1
  P  P17  1  0.188545  0.067045  0.361821  1
  P  P18  1  0.346937  0.045688  0.409440  1
  P  P19  1  0.847832  0.593425  0.400971  1
  P  P20  1  0.347832  0.593425  0.400971  1
  P  P21  1  0.530928  0.635430  0.305824  1
  P  P22  1  0.681166  0.260091  0.400971  1
  P  P23  1  0.689441  0.614782  0.353352  1
  P  P24  1  0.864261  0.302096  0.305824  1
  P  P25  1  0.030928  0.635430  0.305824  1
  P  P26  1  0.181166  0.260091  0.400971  1
  P  P27  1  0.189441  0.614782  0.353352  1
  P  P28  1  0.364261  0.302096  0.305824  1
  P  P29  1  0.514499  0.926758  0.400971  1
  P  P30  1  0.522774  0.281449  0.353352  1
  P  P31  1  0.697594  0.968763  0.305824  1
  P  P32  1  0.856107  0.948115  0.353352  1
  P  P33  1  0.014499  0.926758  0.400971  1
  P  P34  1  0.022774  0.281449  0.353352  1
  P  P35  1  0.197594  0.968763  0.305824  1
  P  P36  1  0.356107  0.948115  0.353352  1
  P  P37  1  0.858983  0.808065  0.291609  1
  P  P38  1  0.358983  0.808065  0.291609  1
  P  P39  1  0.517375  0.786707  0.339228  1
  P  P40  1  0.692317  0.474731  0.291609  1
  P  P41  1  0.675766  0.765350  0.386847  1
  P  P42  1  0.850708  0.453374  0.339228  1
  P  P43  1  0.017375  0.786707  0.339228  1
  P  P44  1  0.192317  0.474731  0.291609  1
  P  P45  1  0.175766  0.765350  0.386847  1
  P  P46  1  0.350708  0.453374  0.339228  1
  P  P47  1  0.525650  0.141398  0.291609  1
  P  P48  1  0.509100  0.432017  0.386847  1
  P  P49  1  0.684041  0.120041  0.339228  1
  P  P50  1  0.842433  0.098683  0.386847  1
  P  P51  1  0.025650  0.141398  0.291609  1
  P  P52  1  0.009100  0.432017  0.386847  1
  P  P53  1  0.184041  0.120041  0.339228  1
  P  P54  1  0.342433  0.098683  0.386847  1
  P  P55  1  0.852336  0.540429  0.423563  1
  P  P56  1  0.352336  0.540429  0.423563  1
  P  P57  1  0.535322  0.583667  0.327915  1
  P  P58  1  0.685669  0.207096  0.423563  1
  P  P59  1  0.693944  0.561786  0.375944  1
  P  P60  1  0.868655  0.250334  0.327915  1
  P  P61  1  0.035322  0.583667  0.327915  1
  P  P62  1  0.185669  0.207096  0.423563  1
  P  P63  1  0.193944  0.561786  0.375944  1
  P  P64  1  0.368655  0.250334  0.327915  1
  P  P65  1  0.519003  0.873762  0.423563  1
  P  P66  1  0.527278  0.228453  0.375944  1
  P  P67  1  0.701989  0.917001  0.327915  1
  P  P68  1  0.860611  0.895120  0.375944  1
  P  P69  1  0.019003  0.873762  0.423563  1
  P  P70  1  0.027278  0.228453  0.375944  1
  P  P71  1  0.201989  0.917001  0.327915  1
  P  P72  1  0.360611  0.895120  0.375944  1
  P  P73  1  0.884624  0.792887  0.323050  1
  P  P74  1  0.384624  0.792887  0.323050  1
  P  P75  1  0.543015  0.771529  0.370669  1
  P  P76  1  0.717957  0.459553  0.323050  1
  P  P77  1  0.701407  0.750172  0.418288  1
  P  P78  1  0.876348  0.438196  0.370669  1
  P  P79  1  0.043015  0.771529  0.370669  1
  P  P80  1  0.217957  0.459553  0.323050  1
  P  P81  1  0.201407  0.750172  0.418288  1
  P  P82  1  0.376348  0.438196  0.370669  1
  P  P83  1  0.551290  0.126220  0.323050  1
  P  P84  1  0.534740  0.416839  0.418288  1
  P  P85  1  0.709682  0.104863  0.370669  1
  P  P86  1  0.868073  0.083506  0.418288  1
  P  P87  1  0.051290  0.126220  0.323050  1
  P  P88  1  0.034740  0.416839  0.418288  1
  P  P89  1  0.209682  0.104863  0.370669  1
  P  P90  1  0.368073  0.083506  0.418288  1
  P  P91  1  0.826696  0.555607  0.392122  1
  P  P92  1  0.326696  0.555607  0.392122  1
  P  P93  1  0.510283  0.598485  0.297173  1
  P  P94  1  0.660029  0.222274  0.392122  1
  P  P95  1  0.668304  0.576964  0.344503  1
  P  P96  1  0.843616  0.265152  0.297173  1
  P  P97  1  0.010283  0.598485  0.297173  1
  P  P98  1  0.160029  0.222274  0.392122  1
  P  P99  1  0.168304  0.576964  0.344503  1
  P  P100  1  0.343616  0.265152  0.297173  1
  P  P101  1  0.493362  0.888940  0.392122  1
  P  P102  1  0.501637  0.243631  0.344503  1
  P  P103  1  0.676949  0.931818  0.297173  1
  P  P104  1  0.834971  0.910297  0.344503  1
  P  P105  1  0.993362  0.888940  0.392122  1
  P  P106  1  0.001637  0.243631  0.344503  1
  P  P107  1  0.176949  0.931818  0.297173  1
  P  P108  1  0.334971  0.910297  0.344503  1
  P  P109  1  0.858098  0.798720  0.354128  1
  P  P110  1  0.358098  0.798720  0.354128  1
  P  P111  1  0.516489  0.777363  0.401747  1
  P  P112  1  0.691431  0.465386  0.354128  1
  P  P113  1  0.699724  0.820055  0.306480  1
  P  P114  1  0.849823  0.444029  0.401747  1
  P  P115  1  0.016489  0.777363  0.401747  1
  P  P116  1  0.191431  0.465386  0.354128  1
  P  P117  1  0.199724  0.820055  0.306480  1
  P  P118  1  0.349823  0.444029  0.401747  1
  P  P119  1  0.524764  0.132053  0.354128  1
  P  P120  1  0.533057  0.486722  0.306480  1
  P  P121  1  0.683156  0.110696  0.401747  1
  P  P122  1  0.866391  0.153389  0.306480  1
  P  P123  1  0.024764  0.132053  0.354128  1
  P  P124  1  0.033057  0.486722  0.306480  1
  P  P125  1  0.183156  0.110696  0.401747  1
  P  P126  1  0.366391  0.153389  0.306480  1
  P  P127  1  0.853222  0.549774  0.361044  1
  P  P128  1  0.353222  0.549774  0.361044  1
  P  P129  1  0.511613  0.528417  0.408663  1
  P  P130  1  0.686555  0.216440  0.361044  1
  P  P131  1  0.694830  0.571131  0.313425  1
  P  P132  1  0.844947  0.195083  0.408663  1
  P  P133  1  0.011613  0.528417  0.408663  1
  P  P134  1  0.186555  0.216440  0.361044  1
  P  P135  1  0.194830  0.571131  0.313425  1
  P  P136  1  0.344947  0.195083  0.408663  1
  P  P137  1  0.519888  0.883107  0.361044  1
  P  P138  1  0.528163  0.237798  0.313425  1
  P  P139  1  0.678280  0.861750  0.408663  1
  P  P140  1  0.861497  0.904464  0.313425  1
  P  P141  1  0.019888  0.883107  0.361044  1
  P  P142  1  0.028163  0.237798  0.313425  1
  P  P143  1  0.178280  0.861750  0.408663  1
  P  P144  1  0.361497  0.904464  0.313425  1
  P  P145  1  0.906683  0.665819  0.419019  1
  P  P146  1  0.406683  0.665819  0.419019  1
  P  P147  1  0.589665  0.708984  0.323286  1
  P  P148  1  0.740016  0.332485  0.419019  1
  P  P149  1  0.748291  0.687176  0.371400  1
  P  P150  1  0.922998  0.375650  0.323286  1
  P  P151  1  0.089665  0.708984  0.323286  1
  P  P152  1  0.240016  0.332485  0.419019  1
  P  P153  1  0.248291  0.687176  0.371400  1
  P  P154  1  0.422998  0.375650  0.323286  1
  P  P155  1  0.573349  0.999152  0.419019  1
  P  P156  1  0.581624  0.353843  0.371400  1
  P  P157  1  0.756332  0.042317  0.323286  1
  P  P158  1  0.914958  0.020509  0.371400  1
  P  P159  1  0.073349  0.999152  0.419019  1
  P  P160  1  0.081624  0.353843  0.371400  1
  P  P161  1  0.256332  0.042317  0.323286  1
  P  P162  1  0.414958  0.020509  0.371400  1
  P  P163  1  0.804637  0.682675  0.296153  1
  P  P164  1  0.304637  0.682675  0.296153  1
  P  P165  1  0.463028  0.661318  0.343772  1
  P  P166  1  0.637970  0.349342  0.296153  1
  P  P167  1  0.621420  0.639960  0.391391  1
  P  P168  1  0.796362  0.327984  0.343772  1
  P  P169  1  0.963028  0.661318  0.343772  1
  P  P170  1  0.137970  0.349342  0.296153  1
  P  P171  1  0.121420  0.639960  0.391391  1
  P  P172  1  0.296362  0.327984  0.343772  1
  P  P173  1  0.471303  0.016008  0.296153  1
  P  P174  1  0.454753  0.306627  0.391391  1
  P  P175  1  0.629695  0.994651  0.343772  1
  P  P176  1  0.788086  0.973294  0.391391  1
  P  P177  1  0.971303  0.016008  0.296153  1
  P  P178  1  0.954753  0.306627  0.391391  1
  P  P179  1  0.129695  0.994651  0.343772  1
  P  P180  1  0.288086  0.973294  0.391391  1
  P  P181  1  0.881816  0.674330  0.382898  1
  P  P182  1  0.381816  0.674330  0.382898  1
  P  P183  1  0.565383  0.717286  0.287973  1
  P  P184  1  0.715149  0.340996  0.382898  1
  P  P185  1  0.723424  0.695687  0.335279  1
  P  P186  1  0.898717  0.383953  0.287973  1
  P  P187  1  0.065383  0.717286  0.287973  1
  P  P188  1  0.215149  0.340996  0.382898  1
  P  P189  1  0.223424  0.695687  0.335279  1
  P  P190  1  0.398717  0.383953  0.287973  1
  P  P191  1  0.548483  0.007663  0.382898  1
  P  P192  1  0.556758  0.362354  0.335279  1
  P  P193  1  0.732050  0.050620  0.287973  1
  P  P194  1  0.890091  0.029020  0.335279  1
  P  P195  1  0.048483  0.007663  0.382898  1
  P  P196  1  0.056758  0.362354  0.335279  1
  P  P197  1  0.232050  0.050620  0.287973  1
  P  P198  1  0.390091  0.029020  0.335279  1
  P  P199  1  0.829503  0.674164  0.332274  1
  P  P200  1  0.329503  0.674164  0.332274  1
  P  P201  1  0.487895  0.652807  0.379893  1
  P  P202  1  0.662837  0.340831  0.332274  1
  P  P203  1  0.646287  0.631449  0.427512  1
  P  P204  1  0.821228  0.319473  0.379893  1
  P  P205  1  0.987895  0.652807  0.379893  1
  P  P206  1  0.162837  0.340831  0.332274  1
  P  P207  1  0.146287  0.631449  0.427512  1
  P  P208  1  0.321228  0.319473  0.379893  1
  P  P209  1  0.496170  0.007497  0.332274  1
  P  P210  1  0.479620  0.298116  0.427512  1
  P  P211  1  0.654562  0.986140  0.379893  1
  P  P212  1  0.812953  0.964783  0.427512  1
  P  P213  1  0.996170  0.007497  0.332274  1
  P  P214  1  0.979620  0.298116  0.427512  1
  P  P215  1  0.154562  0.986140  0.379893  1
  P  P216  1  0.312953  0.964783  0.427512  1
  P  P217  1  0.900991  0.715917  0.389999  1
  P  P218  1  0.400991  0.715917  0.389999  1
  P  P219  1  0.584112  0.757913  0.294915  1
  P  P220  1  0.734324  0.382584  0.389999  1
  P  P221  1  0.742599  0.737274  0.342380  1
  P  P222  1  0.917446  0.424580  0.294915  1
  P  P223  1  0.084112  0.757913  0.294915  1
  P  P224  1  0.234324  0.382584  0.389999  1
  P  P225  1  0.242599  0.737274  0.342380  1
  P  P226  1  0.417446  0.424580  0.294915  1
  P  P227  1  0.567657  0.049250  0.389999  1
  P  P228  1  0.575932  0.403941  0.342380  1
  P  P229  1  0.750779  0.091246  0.294915  1
  P  P230  1  0.909266  0.070608  0.342380  1
  P  P231  1  0.067657  0.049250  0.389999  1
  P  P232  1  0.075932  0.403941  0.342380  1
  P  P233  1  0.250779  0.091246  0.294915  1
  P  P234  1  0.409266  0.070608  0.342380  1
  P  P235  1  0.810329  0.632576  0.325173  1
  P  P236  1  0.310329  0.632576  0.325173  1
  P  P237  1  0.468720  0.611219  0.372792  1
  P  P238  1  0.643662  0.299243  0.325173  1
  P  P239  1  0.627112  0.589862  0.420411  1
  P  P240  1  0.802053  0.277886  0.372792  1
  P  P241  1  0.968720  0.611219  0.372792  1
  P  P242  1  0.143662  0.299243  0.325173  1
  P  P243  1  0.127112  0.589862  0.420411  1
  P  P244  1  0.302053  0.277886  0.372792  1
  P  P245  1  0.476995  0.965910  0.325173  1
  P  P246  1  0.460445  0.256529  0.420411  1
  P  P247  1  0.635387  0.944553  0.372792  1
  P  P248  1  0.793778  0.923195  0.420411  1
  P  P249  1  0.976995  0.965910  0.325173  1
  P  P250  1  0.960445  0.256529  0.420411  1
  P  P251  1  0.135387  0.944553  0.372792  1
  P  P252  1  0.293778  0.923195  0.420411  1
  P  P253  1  0.909406  0.669578  0.356009  1
  P  P254  1  0.409406  0.669578  0.356009  1
  P  P255  1  0.567798  0.648220  0.403628  1
  P  P256  1  0.742740  0.336244  0.356009  1
  P  P257  1  0.751015  0.690935  0.308390  1
  P  P258  1  0.901131  0.314887  0.403628  1
  P  P259  1  0.067798  0.648220  0.403628  1
  P  P260  1  0.242740  0.336244  0.356009  1
  P  P261  1  0.251015  0.690935  0.308390  1
  P  P262  1  0.401131  0.314887  0.403628  1
  P  P263  1  0.576073  0.002911  0.356009  1
  P  P264  1  0.584348  0.357602  0.308390  1
  P  P265  1  0.734465  0.981554  0.403628  1
  P  P266  1  0.917682  0.024268  0.308390  1
  P  P267  1  0.076073  0.002911  0.356009  1
  P  P268  1  0.084348  0.357602  0.308390  1
  P  P269  1  0.234465  0.981554  0.403628  1
  P  P270  1  0.417682  0.024268  0.308390  1
  P  P271  1  0.801913  0.678916  0.359163  1
  P  P272  1  0.301913  0.678916  0.359163  1
  P  P273  1  0.460304  0.657559  0.406782  1
  P  P274  1  0.635246  0.345583  0.359163  1
  P  P275  1  0.643542  0.700247  0.311517  1
  P  P276  1  0.793638  0.324225  0.406782  1
  P  P277  1  0.960304  0.657559  0.406782  1
  P  P278  1  0.135246  0.345583  0.359163  1
  P  P279  1  0.143542  0.700247  0.311517  1
  P  P280  1  0.293638  0.324225  0.406782  1
  P  P281  1  0.468579  0.012249  0.359163  1
  P  P282  1  0.476876  0.366914  0.311517  1
  P  P283  1  0.626971  0.990892  0.406782  1
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  P  P1296  1  0.363454  0.797151  0.622244  1
