# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   41.27571106
_cell_length_b   34.63604010
_cell_length_c   48.88859250
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   84.27690650
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P756
_cell_volume   69544.0788618
_cell_formula_units_Z   756
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  0.028376  0.386714  0.302823  1
  P  P2  1  0.024314  0.753520  0.351903  1
  P  P3  1  0.022577  0.119608  0.401537  1
  P  P4  1  0.015180  0.293497  0.307931  1
  P  P5  1  0.010853  0.659829  0.356929  1
  P  P6  1  0.011980  0.025236  0.406205  1
  P  P7  1  0.635234  0.275030  0.391371  1
  P  P8  1  0.645532  0.521551  0.319505  1
  P  P9  1  0.636823  0.899222  0.350142  1
  P  P10  1  0.457238  0.432781  0.394303  1
  P  P11  1  0.466028  0.691196  0.300150  1
  P  P12  1  0.463786  0.062586  0.345553  1
  P  P13  1  0.460525  0.248106  0.369377  1
  P  P14  1  0.457476  0.618366  0.418457  1
  P  P15  1  0.465125  0.875847  0.322797  1
  P  P16  1  0.021888  0.528104  0.389205  1
  P  P17  1  0.030755  0.796246  0.290960  1
  P  P18  1  0.026245  0.162280  0.341362  1
  P  P19  1  0.397804  0.399517  0.358530  1
  P  P20  1  0.397182  0.770166  0.404181  1
  P  P21  1  0.405232  0.027730  0.309837  1
  P  P22  1  0.644695  0.348518  0.345497  1
  P  P23  1  0.638523  0.711624  0.328336  1
  P  P24  1  0.637341  0.086074  0.375478  1
  P  P25  1  0.395175  0.329727  0.279025  1
  P  P26  1  0.393975  0.694095  0.327587  1
  P  P27  1  0.393228  0.063090  0.375362  1
  P  P28  1  0.387547  0.340150  0.410315  1
  P  P29  1  0.383684  0.605125  0.321297  1
  P  P30  1  0.390167  0.971651  0.359904  1
  P  P31  1  0.449502  0.451203  0.327855  1
  P  P32  1  0.451855  0.818493  0.374068  1
  P  P33  1  0.452188  0.081934  0.280004  1
  P  P34  1  0.908587  0.469122  0.321634  1
  P  P35  1  0.902759  0.839114  0.371418  1
  P  P36  1  0.912627  0.108583  0.275049  1
  P  P37  1  0.131235  0.352469  0.373140  1
  P  P38  1  0.134633  0.622022  0.280436  1
  P  P39  1  0.135669  0.985337  0.327172  1
  P  P40  1  0.856951  0.534245  0.299119  1
  P  P41  1  0.846653  0.901190  0.348478  1
  P  P42  1  0.840534  0.267999  0.398862  1
  P  P43  1  0.131399  0.529987  0.397285  1
  P  P44  1  0.118088  0.800870  0.292310  1
  P  P45  1  0.134852  0.163573  0.348579  1
  P  P46  1  0.326576  0.392086  0.385649  1
  P  P47  1  0.322536  0.676705  0.313647  1
  P  P48  1  0.337434  0.064172  0.333755  1
  P  P49  1  0.451260  0.265204  0.303550  1
  P  P50  1  0.452078  0.633057  0.352253  1
  P  P51  1  0.451772  1.002738  0.397423  1
  P  P52  1  0.579881  0.484883  0.330501  1
  P  P53  1  0.585223  0.850415  0.382386  1
  P  P54  1  0.585938  0.115529  0.286965  1
  P  P55  1  0.009600  0.616694  0.417581  1
  P  P56  1  0.013320  0.887277  0.323275  1
  P  P57  1  0.013551  0.250594  0.369268  1
  P  P58  1  0.966719  0.225022  0.319328  1
  P  P59  1  0.961898  0.591442  0.367656  1
  P  P60  1  0.974779  0.862764  0.271380  1
  P  P61  1  0.071031  0.370424  0.414214  1
  P  P62  1  0.071348  0.637204  0.316390  1
  P  P63  1  0.074091  1.003523  0.365408  1
  P  P64  1  0.030745  0.205010  0.281235  1
  P  P65  1  0.023859  0.568959  0.327171  1
  P  P66  1  0.024073  0.937172  0.377910  1
  P  P67  1  0.573685  0.331844  0.373591  1
  P  P68  1  0.584461  0.575973  0.287212  1
  P  P69  1  0.577240  0.959008  0.325822  1
  P  P70  1  0.398110  0.308148  0.346046  1
  P  P71  1  0.397225  0.678538  0.393927  1
  P  P72  1  0.406633  0.935060  0.298437  1
  P  P73  1  0.634933  0.366416  0.408775  1
  P  P74  1  0.640466  0.617002  0.319358  1
  P  P75  1  0.636574  0.993975  0.358838  1
  P  P76  1  0.575525  0.237732  0.361742  1
  P  P77  1  0.573245  0.605802  0.411914  1
  P  P78  1  0.578699  0.864806  0.315348  1
  P  P79  1  0.845353  0.489942  0.359408  1
  P  P80  1  0.839480  0.857664  0.409827  1
  P  P81  1  0.848986  0.122965  0.312696  1
  P  P82  1  0.643577  0.431485  0.300073  1
  P  P83  1  0.638235  0.805362  0.339960  1
  P  P84  1  0.636689  0.179732  0.385008  1
  P  P85  1  0.955504  0.359433  0.288520  1
  P  P86  1  0.952051  0.725624  0.337006  1
  P  P87  1  0.951379  0.089220  0.385996  1
  P  P88  1  0.894082  0.378071  0.328899  1
  P  P89  1  0.888888  0.746654  0.376875  1
  P  P90  1  0.896769  0.017970  0.280474  1
  P  P91  1  0.457039  0.525125  0.406705  1
  P  P92  1  0.465253  0.782953  0.311286  1
  P  P93  1  0.461478  0.155041  0.358028  1
  P  P94  1  0.521436  0.281326  0.404781  1
  P  P95  1  0.518333  0.541443  0.310366  1
  P  P96  1  0.524998  0.909480  0.358004  1
  P  P97  1  0.844800  0.311410  0.338464  1
  P  P98  1  0.840363  0.679610  0.387311  1
  P  P99  1  0.852843  0.947334  0.290160  1
  P  P100  1  0.076087  0.230046  0.329743  1
  P  P101  1  0.071848  0.594825  0.376812  1
  P  P102  1  0.066724  0.873919  0.278501  1
  P  P103  1  0.395818  0.491988  0.372130  1
  P  P104  1  0.395796  0.863072  0.416017  1
  P  P105  1  0.399856  0.121770  0.324778  1
  P  P106  1  0.389097  0.420531  0.294112  1
  P  P107  1  0.391850  0.786265  0.338301  1
  P  P108  1  0.388451  0.156295  0.386817  1
  P  P109  1  0.589879  0.299066  0.313280  1
  P  P110  1  0.586235  0.664112  0.360038  1
  P  P111  1  0.584782  0.035864  0.404309  1
  P  P112  1  0.448771  0.541994  0.340581  1
  P  P113  1  0.450856  0.911136  0.385380  1
  P  P114  1  0.453347  0.172445  0.292393  1
  P  P115  1  0.950140  0.541834  0.310406  1
  P  P116  1  0.951072  0.907202  0.361528  1
  P  P117  1  0.949692  0.271798  0.409515  1
  P  P118  1  0.084908  0.281589  0.385333  1
  P  P119  1  0.088122  0.551237  0.288680  1
  P  P120  1  0.087408  0.914890  0.336218  1
  P  P121  1  0.525958  0.354229  0.288321  1
  P  P122  1  0.526446  0.723143  0.334709  1
  P  P123  1  0.523674  0.096105  0.380769  1
  P  P124  1  0.009622  0.434474  0.394492  1
  P  P125  1  0.012160  0.704628  0.295704  1
  P  P126  1  0.014334  0.068078  0.345165  1
  P  P127  1  0.641491  0.441963  0.362997  1
  P  P128  1  0.644332  0.792062  0.406572  1
  P  P129  1  0.645969  0.062847  0.313251  1
  P  P130  1  0.585514  0.207341  0.299599  1
  P  P131  1  0.584895  0.572683  0.350325  1
  P  P132  1  0.585597  0.943539  0.392880  1
  P  P133  1  0.966139  0.407593  0.343968  1
  P  P134  1  0.961158  0.775485  0.393151  1
  P  P135  1  0.969373  0.043088  0.295213  1
  P  P136  1  0.885964  0.519562  0.412564  1
  P  P137  1  0.893012  0.788601  0.316062  1
  P  P138  1  0.890372  0.153339  0.364435  1
  P  P139  1  0.024469  0.344064  0.364572  1
  P  P140  1  0.020307  0.711199  0.413655  1
  P  P141  1  0.027488  0.977831  0.315517  1
  P  P142  1  0.514531  0.296256  0.337588  1
  P  P143  1  0.513373  0.664878  0.386733  1
  P  P144  1  0.517911  0.924882  0.291934  1
  P  P145  1  0.852374  0.352047  0.279652  1
  P  P146  1  0.848304  0.716888  0.325212  1
  P  P147  1  0.841821  0.085323  0.374870  1
  P  P148  1  0.971294  0.451155  0.282694  1
  P  P149  1  0.966456  0.818060  0.331827  1
  P  P150  1  0.962017  0.183831  0.380883  1
  P  P151  1  0.070072  0.414687  0.353524  1
  P  P152  1  0.070938  0.777772  0.401582  1
  P  P153  1  0.075263  0.046617  0.304134  1
  P  P154  1  0.573278  0.422523  0.386163  1
  P  P155  1  0.581331  0.673903  0.294336  1
  P  P156  1  0.576008  0.052707  0.337270  1
  P  P157  1  0.132488  0.204232  0.288494  1
  P  P158  1  0.133829  0.575020  0.337695  1
  P  P159  1  0.132958  0.939110  0.386134  1
  P  P160  1  0.338910  0.365238  0.321842  1
  P  P161  1  0.337133  0.735991  0.366862  1
  P  P162  1  0.334880  0.106989  0.415292  1
  P  P163  1  0.512385  0.572036  0.375463  1
  P  P164  1  0.519298  0.831125  0.281806  1
  P  P165  1  0.514707  0.204195  0.326072  1
  P  P166  1  0.142445  0.443370  0.368458  1
  P  P167  1  0.144021  0.666461  0.336814  1
  P  P168  1  0.145801  0.076437  0.322153  1
  P  P169  1  0.068529  0.461638  0.291521  1
  P  P170  1  0.072632  0.822729  0.341509  1
  P  P171  1  0.074637  0.186607  0.390229  1
  P  P172  1  0.901882  0.429687  0.384111  1
  P  P173  1  0.910737  0.701473  0.286130  1
  P  P174  1  0.906254  0.064446  0.336063  1
  P  P175  1  0.086559  0.323513  0.324633  1
  P  P176  1  0.081956  0.688681  0.373308  1
  P  P177  1  0.091261  0.959768  0.278085  1
  P  P178  1  0.898315  0.614037  0.408301  1
  P  P179  1  0.909077  0.880148  0.309007  1
  P  P180  1  0.902815  0.247007  0.359228  1
  P  P181  1  0.889625  0.335222  0.389390  1
  P  P182  1  0.892847  0.611474  0.293576  1
  P  P183  1  0.893661  0.970693  0.341121  1
  P  P184  1  0.397345  0.584387  0.384443  1
  P  P185  1  0.406981  0.843276  0.288093  1
  P  P186  1  0.400219  0.214690  0.335882  1
  P  P187  1  0.349324  0.271151  0.302249  1
  P  P188  1  0.334166  0.642344  0.371806  1
  P  P189  1  0.335335  0.016954  0.397916  1
  P  P190  1  0.511626  0.481325  0.362739  1
  P  P191  1  0.512103  0.851225  0.410037  1
  P  P192  1  0.515193  0.112484  0.313763  1
  P  P193  1  0.949169  0.498831  0.372930  1
  P  P194  1  0.956405  0.772727  0.276436  1
  P  P195  1  0.954564  0.132509  0.325704  1
  P  P196  1  0.831653  0.398378  0.367904  1
  P  P197  1  0.827546  0.765464  0.418393  1
  P  P198  1  0.835085  0.032149  0.320976  1
  P  P199  1  0.126760  0.398171  0.312144  1
  P  P200  1  0.130794  0.757261  0.358679  1
  P  P201  1  0.133180  0.122426  0.410312  1
  P  P202  1  0.081812  0.464128  0.409864  1
  P  P203  1  0.085543  0.726757  0.311191  1
  P  P204  1  0.085387  0.096853  0.361761  1
  P  P205  1  0.010535  0.478525  0.333413  1
  P  P206  1  0.011181  0.842889  0.382774  1
  P  P207  1  0.015092  0.113572  0.284894  1
  P  P208  1  0.519268  0.373968  0.417357  1
  P  P209  1  0.524751  0.630176  0.323008  1
  P  P210  1  0.524466  1.002683  0.369028  1
  P  P211  1  0.084518  0.506500  0.347696  1
  P  P212  1  0.083167  0.872495  0.397193  1
  P  P213  1  0.086969  0.138557  0.300633  1
  P  P214  1  0.386462  0.512696  0.307947  1
  P  P215  1  0.390807  0.878425  0.349504  1
  P  P216  1  0.387600  0.248432  0.398168  1
  P  P217  1  0.953278  0.314053  0.348844  1
  P  P218  1  0.949192  0.681476  0.397971  1
  P  P219  1  0.954382  0.950434  0.299284  1
  P  P220  1  0.908391  0.289028  0.298888  1
  P  P221  1  0.904323  0.657195  0.348297  1
  P  P222  1  0.899759  0.022377  0.396546  1
  P  P223  1  0.575795  0.511689  0.398604  1
  P  P224  1  0.579749  0.770428  0.304508  1
  P  P225  1  0.578103  0.144699  0.349191  1
  P  P226  1  0.459418  0.339905  0.381377  1
  P  P227  1  0.455628  0.601792  0.290752  1
  P  P228  1  0.464587  0.969194  0.334067  1
  P  P229  1  0.518969  0.448108  0.298424  1
  P  P230  1  0.525688  0.816016  0.347084  1
  P  P231  1  0.522604  0.188737  0.392662  1
  P  P232  1  0.890044  0.562980  0.352473  1
  P  P233  1  0.887422  0.927742  0.401450  1
  P  P234  1  0.895243  0.194647  0.304414  1
  P  P235  1  0.511496  0.389768  0.350697  1
  P  P236  1  0.512992  0.757956  0.398493  1
  P  P237  1  0.515554  0.019469  0.301988  1
  P  P238  1  0.960583  0.366113  0.405153  1
  P  P239  1  0.966161  0.634516  0.306890  1
  P  P240  1  0.964922  1.000257  0.356131  1
  P  P241  1  0.581583  0.393425  0.321974  1
  P  P242  1  0.586382  0.756593  0.371386  1
  P  P243  1  0.583382  0.129501  0.416100  1
  P  P244  1  0.336060  0.458376  0.338980  1
  P  P245  1  0.337199  0.828852  0.381377  1
  P  P246  1  0.368757  0.092915  0.271566  1
  P  P247  1  0.334959  0.551819  0.353192  1
  P  P248  1  0.337035  0.922678  0.391135  1
  P  P249  1  0.377222  0.185129  0.277120  1
  P  P250  1  0.452825  0.358646  0.314922  1
  P  P251  1  0.453295  0.725739  0.362884  1
  P  P252  1  0.451386  0.096003  0.409673  1
  P  P253  1  0.018468  0.485958  0.449886  1
  P  P254  1  0.016857  0.851742  0.497773  1
  P  P255  1  0.015095  0.217592  0.545888  1
  P  P256  1  1.008296  0.391266  0.454536  1
  P  P257  1  1.006488  0.756744  0.502328  1
  P  P258  1  1.004118  0.123383  0.551038  1
  P  P259  1  0.628603  0.380453  0.540684  1
  P  P260  1  0.632934  0.639179  0.447942  1
  P  P261  1  0.632125  1.008828  0.493487  1
  P  P262  1  0.450481  0.544153  0.535377  1
  P  P263  1  0.456859  0.803453  0.440603  1
  P  P264  1  0.456224  0.173666  0.487147  1
  P  P265  1  0.452366  0.358400  0.511523  1
  P  P266  1  0.449093  0.729709  0.558812  1
  P  P267  1  0.456123  0.988669  0.463196  1
  P  P268  1  0.014095  0.626608  0.533812  1
  P  P269  1  0.020131  0.894725  0.438243  1
  P  P270  1  0.017884  0.260465  0.485899  1
  P  P271  1  0.390144  0.510484  0.500538  1
  P  P272  1  0.389255  0.881612  0.545432  1
  P  P273  1  0.395573  0.140005  0.451505  1
  P  P274  1  0.635352  0.455723  0.427486  1
  P  P275  1  0.632795  0.824550  0.469175  1
  P  P276  1  0.631839  0.196347  0.512303  1
  P  P277  1  0.383016  0.433174  0.422195  1
  P  P278  1  0.382899  0.804433  0.467404  1
  P  P279  1  0.382699  0.173177  0.514273  1
  P  P280  1  0.377253  0.450373  0.551998  1
  P  P281  1  0.384762  0.711400  0.456922  1
  P  P282  1  0.383539  0.080508  0.502548  1
  P  P283  1  0.443814  0.559286  0.469111  1
  P  P284  1  0.443979  0.929046  0.514661  1
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  P  P756  1  0.435920  0.318981  0.691586  1
