# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   20.74870871
_cell_length_b   15.56320899
_cell_length_c   41.85194923
_cell_angle_alpha   90.00000000
_cell_angle_beta   96.34273726
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P335
_cell_volume   13431.9588213
_cell_formula_units_Z   335
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  0.276714  0.199529  0.967059  1
  P  P2  1  0.276714  0.699529  0.967059  1
  P  P3  1  0.776714  0.199529  0.967059  1
  P  P4  1  0.776714  0.699529  0.967059  1
  P  P5  1  0.129056  0.283786  0.975361  1
  P  P6  1  0.129056  0.783786  0.975361  1
  P  P7  1  0.629056  0.283786  0.975361  1
  P  P8  1  0.629056  0.783786  0.975361  1
  P  P9  1  0.017024  0.050956  0.354797  1
  P  P10  1  0.017100  0.550764  0.354811  1
  P  P11  1  0.516999  0.050953  0.354768  1
  P  P12  1  0.516791  0.550753  0.354770  1
  P  P13  1  0.269668  0.409357  0.529139  1
  P  P14  1  0.269818  0.908535  0.527966  1
  P  P15  1  0.769440  0.409064  0.528143  1
  P  P16  1  0.769600  0.909110  0.528163  1
  P  P17  1  0.019611  0.158799  0.528525  1
  P  P18  1  0.019797  0.659070  0.528816  1
  P  P19  1  0.519887  0.159383  0.528713  1
  P  P20  1  0.519820  0.659286  0.528646  1
  P  P21  1  0.401840  0.323624  0.966889  1
  P  P22  1  0.401840  0.823624  0.966889  1
  P  P23  1  0.901840  0.323624  0.966889  1
  P  P24  1  0.901840  0.823624  0.966889  1
  P  P25  1  0.263039  0.041856  0.588786  1
  P  P26  1  0.262819  0.541996  0.590590  1
  P  P27  1  0.762925  0.042686  0.588880  1
  P  P28  1  0.762928  0.542712  0.588874  1
  P  P29  1  0.267549  0.301190  0.354239  1
  P  P30  1  0.268082  0.802393  0.354357  1
  P  P31  1  0.767932  0.302016  0.354174  1
  P  P32  1  0.767996  0.801992  0.354202  1
  P  P33  1  0.239940  0.331650  0.599090  1
  P  P34  1  0.240423  0.831568  0.597483  1
  P  P35  1  0.740644  0.331833  0.598253  1
  P  P36  1  0.740672  0.831985  0.598206  1
  P  P37  1  0.114918  0.456868  0.598777  1
  P  P38  1  0.115723  0.957691  0.598755  1
  P  P39  1  0.615419  0.457762  0.598266  1
  P  P40  1  0.615221  0.958200  0.598257  1
  P  P41  1  0.372621  0.074592  0.537215  1
  P  P42  1  0.372497  0.573837  0.537507  1
  P  P43  1  0.872801  0.074216  0.537161  1
  P  P44  1  0.872781  0.574357  0.537161  1
  P  P45  1  0.387507  0.059454  0.090066  1
  P  P46  1  0.387507  0.559454  0.090066  1
  P  P47  1  0.887507  0.059454  0.090066  1
  P  P48  1  0.887507  0.559454  0.090066  1
  P  P49  1  0.145420  0.044774  0.854381  1
  P  P50  1  0.145420  0.544774  0.854381  1
  P  P51  1  0.645420  0.044774  0.854381  1
  P  P52  1  0.645420  0.544774  0.854381  1
  P  P53  1  0.506950  0.050732  0.149435  1
  P  P54  1  0.506950  0.550732  0.149435  1
  P  P55  1  1.006950  0.050732  0.149435  1
  P  P56  1  1.006950  0.550732  0.149435  1
  P  P57  1  0.391074  0.301778  0.854083  1
  P  P58  1  0.391074  0.801778  0.854083  1
  P  P59  1  0.891074  0.301778  0.854083  1
  P  P60  1  0.891074  0.801778  0.854083  1
  P  P61  1  0.236845  0.960382  0.657479  1
  P  P62  1  0.732913  0.466350  0.657387  1
  P  P63  1  0.733020  0.966147  0.657372  1
  P  P64  1  0.122172  0.323945  0.537537  1
  P  P65  1  0.122101  0.823483  0.537193  1
  P  P66  1  0.622077  0.323762  0.537238  1
  P  P67  1  0.622150  0.823934  0.537203  1
  P  P68  1  0.408561  0.017653  0.405777  1
  P  P69  1  0.408786  0.517664  0.405987  1
  P  P70  1  0.908714  0.017716  0.405774  1
  P  P71  1  0.908835  0.517795  0.405867  1
  P  P72  1  0.504076  0.159054  0.975431  1
  P  P73  1  0.504076  0.659054  0.975431  1
  P  P74  1  1.004076  0.159054  0.975431  1
  P  P75  1  1.004076  0.659054  0.975431  1
  P  P76  1  0.019893  0.316390  0.028771  1
  P  P77  1  0.019893  0.816390  0.028771  1
  P  P78  1  0.519893  0.316390  0.028771  1
  P  P79  1  0.519893  0.816390  0.028771  1
  P  P80  1  0.136462  0.415990  0.914135  1
  P  P81  1  0.136462  0.915990  0.914135  1
  P  P82  1  0.636462  0.415990  0.914135  1
  P  P83  1  0.636462  0.915990  0.914135  1
  P  P84  1  0.026610  0.448776  0.966854  1
  P  P85  1  0.026610  0.948776  0.966854  1
  P  P86  1  0.526610  0.448776  0.966854  1
  P  P87  1  0.526610  0.948776  0.966854  1
  P  P88  1  0.136459  0.059628  0.414161  1
  P  P89  1  0.136467  0.559304  0.414229  1
  P  P90  1  0.636409  0.059631  0.414085  1
  P  P91  1  0.636383  0.559632  0.414082  1
  P  P92  1  0.137437  0.165643  0.589921  1
  P  P93  1  0.137813  0.666394  0.590519  1
  P  P94  1  0.637863  0.166405  0.590521  1
  P  P95  1  0.638111  0.666424  0.590455  1
  P  P96  1  0.145482  0.430673  0.354437  1
  P  P97  1  0.145145  0.930460  0.354452  1
  P  P98  1  0.645416  0.430963  0.354332  1
  P  P99  1  0.645399  0.930831  0.354355  1
  P  P100  1  1.010869  0.184179  0.413980  1
  P  P101  1  1.010939  0.684001  0.413985  1
  P  P102  1  0.510709  0.184180  0.413905  1
  P  P103  1  0.510769  0.684132  0.413927  1
  P  P104  1  0.378549  0.430670  0.149821  1
  P  P105  1  0.378549  0.930670  0.149821  1
  P  P106  1  0.878549  0.430670  0.149821  1
  P  P107  1  0.878549  0.930670  0.149821  1
  P  P108  1  0.390959  0.173798  0.354136  1
  P  P109  1  0.390868  0.673614  0.354145  1
  P  P110  1  0.891097  0.173872  0.354087  1
  P  P111  1  0.891191  0.673818  0.354107  1
  P  P112  1  0.247255  0.275915  0.037143  1
  P  P113  1  0.247255  0.775915  0.037143  1
  P  P114  1  0.747255  0.275915  0.037143  1
  P  P115  1  0.747255  0.775915  0.037143  1
  P  P116  1  0.240609  0.143619  0.098284  1
  P  P117  1  0.240609  0.643619  0.098284  1
  P  P118  1  0.740609  0.143619  0.098284  1
  P  P119  1  0.740609  0.643619  0.098284  1
  P  P120  1  0.394932  0.284073  0.529062  1
  P  P121  1  0.394912  0.783875  0.528691  1
  P  P122  1  0.894576  0.283796  0.528633  1
  P  P123  1  0.894878  0.783986  0.528783  1
  P  P124  1  0.026569  0.026559  0.466794  1
  P  P125  1  0.026704  0.526758  0.467013  1
  P  P126  1  0.526511  0.026850  0.466769  1
  P  P127  1  0.526594  0.526735  0.466822  1
  P  P128  1  0.132895  0.173666  0.150118  1
  P  P129  1  0.132895  0.673666  0.150118  1
  P  P130  1  0.632895  0.173666  0.150118  1
  P  P131  1  0.632895  0.673666  0.150118  1
  P  P132  1  1.010863  0.291404  0.913916  1
  P  P133  1  1.010863  0.791404  0.913916  1
  P  P134  1  0.510863  0.291404  0.913916  1
  P  P135  1  0.510863  0.791404  0.913916  1
  P  P136  1  0.387920  0.416555  0.590343  1
  P  P137  1  0.387637  0.916349  0.590075  1
  P  P138  1  0.887092  0.415999  0.589816  1
  P  P139  1  0.887404  0.915996  0.589990  1
  P  P140  1  0.364752  0.207117  0.599084  1
  P  P141  1  0.365985  0.707113  0.598505  1
  P  P142  1  0.865502  0.206460  0.598877  1
  P  P143  1  0.865682  0.706490  0.598874  1
  P  P144  1  0.158452  0.269148  0.405560  1
  P  P145  1  0.158414  0.768712  0.405311  1
  P  P146  1  0.658354  0.269049  0.405169  1
  P  P147  1  0.658394  0.769068  0.405216  1
  P  P148  1  0.497369  0.448918  0.537333  1
  P  P149  1  0.497265  0.949175  0.537259  1
  P  P150  1  0.997403  0.448931  0.537416  1
  P  P151  1  0.997571  0.948753  0.537440  1
  P  P152  1  0.497359  0.026668  0.037348  1
  P  P153  1  0.497359  0.526668  0.037348  1
  P  P154  1  0.997359  0.026668  0.037348  1
  P  P155  1  0.997359  0.526668  0.037348  1
  P  P156  1  0.034544  0.081956  0.905509  1
  P  P157  1  0.034544  0.581956  0.905509  1
  P  P158  1  0.534544  0.081956  0.905509  1
  P  P159  1  0.534544  0.581956  0.905509  1
  P  P160  1  0.276720  0.276428  0.467448  1
  P  P161  1  0.276549  0.775468  0.467069  1
  P  P162  1  0.776562  0.276071  0.466938  1
  P  P163  1  0.776675  0.776112  0.466990  1
  P  P164  1  0.254296  0.408893  0.975946  1
  P  P165  1  0.254296  0.908893  0.975946  1
  P  P166  1  0.754296  0.408893  0.975946  1
  P  P167  1  0.754296  0.908893  0.975946  1
  P  P168  1  0.289912  0.010506  0.346889  1
  P  P169  1  0.291362  0.508466  0.346859  1
  P  P170  1  0.790820  0.009559  0.346700  1
  P  P171  1  0.790999  0.509501  0.346747  1
  P  P172  1  0.034628  0.393687  0.405655  1
  P  P173  1  0.034437  0.893472  0.405468  1
  P  P174  1  0.534485  0.393535  0.405451  1
  P  P175  1  0.534400  0.893595  0.405448  1
  P  P176  1  0.269673  0.066551  0.028255  1
  P  P177  1  0.269673  0.566551  0.028255  1
  P  P178  1  0.769673  0.066551  0.028255  1
  P  P179  1  0.769673  0.566551  0.028255  1
  P  P180  1  0.365515  0.268899  0.098920  1
  P  P181  1  0.365515  0.768899  0.098920  1
  P  P182  1  0.865515  0.268899  0.098920  1
  P  P183  1  0.865515  0.768899  0.098920  1
  P  P184  1  0.151216  0.074201  0.967015  1
  P  P185  1  0.151216  0.574201  0.967015  1
  P  P186  1  0.651216  0.074201  0.967015  1
  P  P187  1  0.651216  0.574201  0.967015  1
  P  P188  1  0.129025  0.191739  0.475539  1
  P  P189  1  0.129144  0.691254  0.475498  1
  P  P190  1  0.628979  0.191869  0.475273  1
  P  P191  1  0.629044  0.691867  0.475298  1
  P  P192  1  0.256043  0.301787  0.149985  1
  P  P193  1  0.256043  0.801787  0.149985  1
  P  P194  1  0.756043  0.301787  0.149985  1
  P  P195  1  0.756043  0.801787  0.149985  1
  P  P196  1  0.394913  0.191658  0.028840  1
  P  P197  1  0.394913  0.691658  0.028840  1
  P  P198  1  0.894913  0.191658  0.028840  1
  P  P199  1  0.894913  0.691658  0.028840  1
  P  P200  1  0.260977  0.042547  0.915249  1
  P  P201  1  0.260977  0.542547  0.915249  1
  P  P202  1  0.760977  0.042547  0.915249  1
  P  P203  1  0.760977  0.542547  0.915249  1
  P  P204  1  0.260911  0.432715  0.415307  1
  P  P205  1  0.260887  0.933028  0.415369  1
  P  P206  1  0.760949  0.433097  0.415198  1
  P  P207  1  0.760997  0.933083  0.415205  1
  P  P208  1  0.017019  0.424712  0.854767  1
  P  P209  1  0.017019  0.924712  0.854767  1
  P  P210  1  0.517019  0.424712  0.854767  1
  P  P211  1  0.517019  0.924712  0.854767  1
  P  P212  1  0.253831  0.169312  0.649683  1
  P  P213  1  0.258481  0.678820  0.649695  1
  P  P214  1  0.756010  0.173643  0.649945  1
  P  P215  1  0.756130  0.673887  0.649925  1
  P  P216  1  0.503949  0.316618  0.475401  1
  P  P217  1  0.504017  0.816576  0.475385  1
  P  P218  1  1.004085  0.316537  0.475495  1
  P  P219  1  1.004129  0.816341  0.475437  1
  P  P220  1  0.290874  0.466092  0.846774  1
  P  P221  1  0.290874  0.966092  0.846774  1
  P  P222  1  0.790874  0.466092  0.846774  1
  P  P223  1  0.790874  0.966092  0.846774  1
  P  P224  1  0.386065  0.166114  0.913619  1
  P  P225  1  0.386065  0.666114  0.913619  1
  P  P226  1  0.886065  0.166114  0.913619  1
  P  P227  1  0.886065  0.666114  0.913619  1
  P  P228  1  0.262992  0.432897  0.088952  1
  P  P229  1  0.262992  0.932897  0.088952  1
  P  P230  1  0.762992  0.432897  0.088952  1
  P  P231  1  0.762992  0.932897  0.088952  1
  P  P232  1  0.158454  0.206545  0.905282  1
  P  P233  1  0.158454  0.706545  0.905282  1
  P  P234  1  0.658454  0.206545  0.905282  1
  P  P235  1  0.658454  0.706545  0.905282  1
  P  P236  1  0.513106  0.184040  0.090285  1
  P  P237  1  0.513106  0.684040  0.090285  1
  P  P238  1  0.013106  0.184040  0.090285  1
  P  P239  1  0.013106  0.684040  0.090285  1
  P  P240  1  0.115185  0.017634  0.098363  1
  P  P241  1  0.115185  0.517634  0.098363  1
  P  P242  1  0.615185  0.017634  0.098363  1
  P  P243  1  0.615185  0.517634  0.098363  1
  P  P244  1  0.513055  0.291693  0.590384  1
  P  P245  1  0.513359  0.791970  0.590132  1
  P  P246  1  0.012433  0.290946  0.589817  1
  P  P247  1  0.013103  0.791377  0.590245  1
  P  P248  1  0.130225  0.297678  0.649279  1
  P  P249  1  0.132855  0.801040  0.650097  1
  P  P250  1  0.632951  0.301862  0.650129  1
  P  P251  1  0.632933  0.801891  0.650015  1
  P  P252  1  0.379417  0.441089  0.476039  1
  P  P253  1  0.379504  0.941404  0.475793  1
  P  P254  1  0.879569  0.441291  0.475824  1
  P  P255  1  0.879673  0.941237  0.475826  1
  P  P256  1  0.372753  0.401243  0.037187  1
  P  P257  1  0.372753  0.901243  0.037187  1
  P  P258  1  0.872753  0.401243  0.037187  1
  P  P259  1  0.872753  0.901243  0.037187  1
  P  P260  1  0.233095  0.009352  0.157427  1
  P  P261  1  0.233095  0.509352  0.157427  1
  P  P262  1  0.733095  0.009352  0.157427  1
  P  P263  1  0.733095  0.509352  0.157427  1
  P  P264  1  0.267926  0.173657  0.854217  1
  P  P265  1  0.267926  0.673657  0.854217  1
  P  P266  1  0.767926  0.173657  0.854217  1
  P  P267  1  0.767926  0.673657  0.854217  1
  P  P268  1  0.283360  0.331825  0.905918  1
  P  P269  1  0.283360  0.831825  0.905918  1
  P  P270  1  0.783360  0.331825  0.905918  1
  P  P271  1  0.783360  0.831825  0.905918  1
  P  P272  1  0.379588  0.034327  0.975837  1
  P  P273  1  0.379588  0.534327  0.975837  1
  P  P274  1  0.879588  0.034327  0.975837  1
  P  P275  1  0.879588  0.534327  0.975837  1
  P  P276  1  0.151329  0.401478  0.467368  1
  P  P277  1  0.151129  0.901110  0.466905  1
  P  P278  1  0.651127  0.401399  0.466924  1
  P  P279  1  0.651147  0.901454  0.466915  1
  P  P280  1  0.408784  0.457810  0.905838  1
  P  P281  1  0.408784  0.957810  0.905838  1
  P  P282  1  0.908784  0.457810  0.905838  1
  P  P283  1  0.908784  0.957810  0.905838  1
  P  P284  1  0.489287  0.082580  0.598572  1
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  P  P286  1  0.989573  0.081658  0.598739  1
  P  P287  1  0.989669  0.581470  0.598824  1
  P  P288  1  0.122129  0.151820  0.037312  1
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  P  P294  1  0.637904  0.309330  0.090582  1
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  P  P299  1  0.886099  0.809405  0.413628  1
  P  P300  1  0.144390  0.033740  0.528314  1
  P  P301  1  0.144566  0.534202  0.528955  1
  P  P302  1  0.644318  0.034601  0.528260  1
  P  P303  1  0.644290  0.534565  0.528286  1
  P  P304  1  0.401804  0.152105  0.466958  1
  P  P305  1  0.401695  0.651563  0.467002  1
  P  P306  1  0.901701  0.151875  0.466766  1
  P  P307  1  0.901804  0.651930  0.466879  1
  P  P308  1  0.489425  0.393488  0.098692  1
  P  P309  1  0.489425  0.893488  0.098692  1
  P  P310  1  0.989425  0.393488  0.098692  1
  P  P311  1  0.989425  0.893488  0.098692  1
  P  P312  1  0.254183  0.066900  0.476075  1
  P  P313  1  0.254255  0.566023  0.476045  1
  P  P314  1  0.754297  0.066722  0.475881  1
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  P  P316  1  0.144381  0.441117  0.028365  1
  P  P317  1  0.144381  0.941117  0.028365  1
  P  P318  1  0.644381  0.441117  0.028365  1
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  P  P320  1  0.283384  0.144004  0.406210  1
  P  P321  1  0.283240  0.643372  0.405901  1
  P  P322  1  0.783266  0.143787  0.405823  1
  P  P323  1  0.783330  0.643770  0.405869  1
  P  P324  1  0.379353  0.045702  0.649813  1
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  P  P326  1  0.878483  0.044700  0.649768  1
  P  P327  1  0.878371  0.544667  0.649731  1
  P  P328  1  0.507538  0.425715  0.649533  1
  P  P329  1  0.507313  0.925214  0.649354  1
  P  P330  1  1.005306  0.422378  0.649214  1
  P  P331  1  1.006537  0.924025  0.649400  1
  P  P332  1  0.247174  0.200004  0.537410  1
  P  P333  1  0.247295  0.698120  0.537301  1
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  P  P335  1  0.747317  0.699727  0.537067  1
