# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   103.17831810
_cell_length_b   50.34576727
_cell_length_c   54.82032859
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   81.13279543
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P1296
_cell_volume   281365.729725
_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  0.644785  0.492718  0.340560  1
  P  P2  1  0.803041  0.485331  0.292941  1
  P  P3  1  0.986529  0.500105  0.388179  1
  P  P4  1  0.978118  0.159385  0.340560  1
  P  P5  1  0.144785  0.492718  0.340560  1
  P  P6  1  0.303041  0.485331  0.292941  1
  P  P7  1  0.486529  0.500105  0.388179  1
  P  P8  1  0.478118  0.159385  0.340560  1
  P  P9  1  0.636375  0.151998  0.292941  1
  P  P10  1  0.819862  0.166771  0.388179  1
  P  P11  1  0.811452  0.826051  0.340560  1
  P  P12  1  0.969708  0.818664  0.292941  1
  P  P13  1  0.136375  0.151998  0.292941  1
  P  P14  1  0.319862  0.166771  0.388179  1
  P  P15  1  0.311452  0.826051  0.340560  1
  P  P16  1  0.469708  0.818664  0.292941  1
  P  P17  1  0.653196  0.833438  0.388179  1
  P  P18  1  0.153196  0.833438  0.388179  1
  P  P19  1  0.641534  0.614021  0.326375  1
  P  P20  1  0.825219  0.628008  0.421690  1
  P  P21  1  0.983475  0.620621  0.374071  1
  P  P22  1  0.974868  0.280688  0.326375  1
  P  P23  1  0.141534  0.614021  0.326375  1
  P  P24  1  0.325219  0.628008  0.421690  1
  P  P25  1  0.483475  0.620621  0.374071  1
  P  P26  1  0.474868  0.280688  0.326375  1
  P  P27  1  0.658552  0.294675  0.421690  1
  P  P28  1  0.816809  0.287288  0.374071  1
  P  P29  1  0.808201  0.947355  0.326375  1
  P  P30  1  0.991886  0.961341  0.421690  1
  P  P31  1  0.158552  0.294675  0.421690  1
  P  P32  1  0.316809  0.287288  0.374071  1
  P  P33  1  0.308201  0.947355  0.326375  1
  P  P34  1  0.491886  0.961341  0.421690  1
  P  P35  1  0.650142  0.953955  0.374071  1
  P  P36  1  0.150142  0.953955  0.374071  1
  P  P37  1  0.644671  0.457163  0.387581  1
  P  P38  1  0.802927  0.449776  0.339962  1
  P  P39  1  0.961198  0.442393  0.292331  1
  P  P40  1  0.978004  0.123830  0.387581  1
  P  P41  1  0.144671  0.457163  0.387581  1
  P  P42  1  0.302927  0.449776  0.339962  1
  P  P43  1  0.461198  0.442393  0.292331  1
  P  P44  1  0.478004  0.123830  0.387581  1
  P  P45  1  0.636260  0.116443  0.339962  1
  P  P46  1  0.794531  0.109059  0.292331  1
  P  P47  1  0.811337  0.790496  0.387581  1
  P  P48  1  0.969594  0.783110  0.339962  1
  P  P49  1  0.136260  0.116443  0.339962  1
  P  P50  1  0.294531  0.109059  0.292331  1
  P  P51  1  0.311337  0.790496  0.387581  1
  P  P52  1  0.469594  0.783110  0.339962  1
  P  P53  1  0.627865  0.775726  0.292331  1
  P  P54  1  0.127865  0.775726  0.292331  1
  P  P55  1  0.667077  0.670950  0.422288  1
  P  P56  1  0.825334  0.663563  0.374669  1
  P  P57  1  0.983590  0.656176  0.327050  1
  P  P58  1  1.000411  0.337616  0.422288  1
  P  P59  1  0.167077  0.670950  0.422288  1
  P  P60  1  0.325334  0.663563  0.374669  1
  P  P61  1  0.483590  0.656176  0.327050  1
  P  P62  1  0.500411  0.337616  0.422288  1
  P  P63  1  0.658667  0.330230  0.374669  1
  P  P64  1  0.816923  0.322843  0.327050  1
  P  P65  1  0.833744  0.004283  0.422288  1
  P  P66  1  0.992000  0.996896  0.374669  1
  P  P67  1  0.158667  0.330230  0.374669  1
  P  P68  1  0.316923  0.322843  0.327050  1
  P  P69  1  0.333744  0.004283  0.422288  1
  P  P70  1  0.492000  0.996896  0.374669  1
  P  P71  1  0.650256  0.989509  0.327050  1
  P  P72  1  0.150256  0.989509  0.327050  1
  P  P73  1  0.670117  0.453244  0.355553  1
  P  P74  1  0.828374  0.445857  0.307934  1
  P  P75  1  0.011861  0.460630  0.403172  1
  P  P76  1  0.003451  0.119910  0.355553  1
  P  P77  1  0.170117  0.453244  0.355553  1
  P  P78  1  0.328374  0.445857  0.307934  1
  P  P79  1  0.511861  0.460630  0.403172  1
  P  P80  1  0.503451  0.119910  0.355553  1
  P  P81  1  0.661707  0.112523  0.307934  1
  P  P82  1  0.845195  0.127297  0.403172  1
  P  P83  1  0.836784  0.786577  0.355553  1
  P  P84  1  0.995040  0.779190  0.307934  1
  P  P85  1  0.161707  0.112523  0.307934  1
  P  P86  1  0.345195  0.127297  0.403172  1
  P  P87  1  0.336784  0.786577  0.355553  1
  P  P88  1  0.495040  0.779190  0.307934  1
  P  P89  1  0.678528  0.793964  0.403172  1
  P  P90  1  0.178528  0.793964  0.403172  1
  P  P91  1  0.616794  0.652582  0.311704  1
  P  P92  1  0.799887  0.667482  0.406697  1
  P  P93  1  0.958143  0.660095  0.359078  1
  P  P94  1  0.950127  0.319249  0.311704  1
  P  P95  1  0.116794  0.652582  0.311704  1
  P  P96  1  0.299887  0.667482  0.406697  1
  P  P97  1  0.458143  0.660095  0.359078  1
  P  P98  1  0.450127  0.319249  0.311704  1
  P  P99  1  0.633220  0.334149  0.406697  1
  P  P100  1  0.791476  0.326762  0.359078  1
  P  P101  1  0.783460  0.985916  0.311704  1
  P  P102  1  0.966553  1.000816  0.406697  1
  P  P103  1  0.133220  0.334149  0.406697  1
  P  P104  1  0.291476  0.326762  0.359078  1
  P  P105  1  0.283460  0.985916  0.311704  1
  P  P106  1  0.466553  1.000816  0.406697  1
  P  P107  1  0.624810  0.993429  0.359078  1
  P  P108  1  0.124810  0.993429  0.359078  1
  P  P109  1  0.645498  0.430372  0.335779  1
  P  P110  1  0.803754  0.422985  0.288160  1
  P  P111  1  0.987242  0.437758  0.383398  1
  P  P112  1  0.978831  0.097038  0.335779  1
  P  P113  1  0.145498  0.430372  0.335779  1
  P  P114  1  0.303754  0.422985  0.288160  1
  P  P115  1  0.487242  0.437758  0.383398  1
  P  P116  1  0.478831  0.097038  0.335779  1
  P  P117  1  0.637087  0.089651  0.288160  1
  P  P118  1  0.820575  0.104425  0.383398  1
  P  P119  1  0.812165  0.763705  0.335779  1
  P  P120  1  0.970421  0.756318  0.288160  1
  P  P121  1  0.137087  0.089651  0.288160  1
  P  P122  1  0.320575  0.104425  0.383398  1
  P  P123  1  0.312165  0.763705  0.335779  1
  P  P124  1  0.470421  0.756318  0.288160  1
  P  P125  1  0.653908  0.771092  0.383398  1
  P  P126  1  0.153908  0.771092  0.383398  1
  P  P127  1  0.640836  0.674924  0.331053  1
  P  P128  1  0.824506  0.690354  0.426471  1
  P  P129  1  0.982762  0.682968  0.378852  1
  P  P130  1  0.974170  0.341590  0.331053  1
  P  P131  1  0.140836  0.674924  0.331053  1
  P  P132  1  0.324506  0.690354  0.426471  1
  P  P133  1  0.482762  0.682968  0.378852  1
  P  P134  1  0.474170  0.341590  0.331053  1
  P  P135  1  0.657840  0.357021  0.426471  1
  P  P136  1  0.816096  0.349634  0.378852  1
  P  P137  1  0.807503  0.008257  0.331053  1
  P  P138  1  0.991173  0.023688  0.426471  1
  P  P139  1  0.157840  0.357021  0.426471  1
  P  P140  1  0.316096  0.349634  0.378852  1
  P  P141  1  0.307503  0.008257  0.331053  1
  P  P142  1  0.491173  0.023688  0.426471  1
  P  P143  1  0.649429  0.016301  0.378852  1
  P  P144  1  0.149429  0.016301  0.378852  1
  P  P145  1  0.708655  0.537073  0.354459  1
  P  P146  1  0.866911  0.529686  0.306840  1
  P  P147  1  0.050399  0.544459  0.402078  1
  P  P148  1  0.041988  0.203739  0.354459  1
  P  P149  1  0.208655  0.537073  0.354459  1
  P  P150  1  0.366911  0.529686  0.306840  1
  P  P151  1  0.550399  0.544459  0.402078  1
  P  P152  1  0.541988  0.203739  0.354459  1
  P  P153  1  0.700245  0.196353  0.306840  1
  P  P154  1  0.883732  0.211126  0.402078  1
  P  P155  1  0.875322  0.870406  0.354459  1
  P  P156  1  0.033578  0.863019  0.306840  1
  P  P157  1  0.200245  0.196353  0.306840  1
  P  P158  1  0.383732  0.211126  0.402078  1
  P  P159  1  0.375322  0.870406  0.354459  1
  P  P160  1  0.533578  0.863019  0.306840  1
  P  P161  1  0.717066  0.877793  0.402078  1
  P  P162  1  0.217066  0.877793  0.402078  1
  P  P163  1  0.577877  0.568870  0.312541  1
  P  P164  1  0.761349  0.583653  0.407791  1
  P  P165  1  0.919605  0.576266  0.360172  1
  P  P166  1  0.911210  0.235537  0.312541  1
  P  P167  1  0.077877  0.568870  0.312541  1
  P  P168  1  0.261349  0.583653  0.407791  1
  P  P169  1  0.419605  0.576266  0.360172  1
  P  P170  1  0.411210  0.235537  0.312541  1
  P  P171  1  0.594682  0.250320  0.407791  1
  P  P172  1  0.752939  0.242933  0.360172  1
  P  P173  1  0.744544  0.902203  0.312541  1
  P  P174  1  0.928016  0.916987  0.407791  1
  P  P175  1  0.094682  0.250320  0.407791  1
  P  P176  1  0.252939  0.242933  0.360172  1
  P  P177  1  0.244544  0.902203  0.312541  1
  P  P178  1  0.428016  0.916987  0.407791  1
  P  P179  1  0.586272  0.909600  0.360172  1
  P  P180  1  0.086272  0.909600  0.360172  1
  P  P181  1  0.683110  0.549714  0.386163  1
  P  P182  1  0.841366  0.542327  0.338544  1
  P  P183  1  1.000015  0.534762  0.291177  1
  P  P184  1  0.016443  0.216380  0.386163  1
  P  P185  1  0.183110  0.549714  0.386163  1
  P  P186  1  0.341366  0.542327  0.338544  1
  P  P187  1  0.500015  0.534762  0.291177  1
  P  P188  1  0.516443  0.216380  0.386163  1
  P  P189  1  0.674700  0.208993  0.338544  1
  P  P190  1  0.833348  0.201428  0.291177  1
  P  P191  1  0.849777  0.883047  0.386163  1
  P  P192  1  0.008033  0.875660  0.338544  1
  P  P193  1  0.174700  0.208993  0.338544  1
  P  P194  1  0.333348  0.201428  0.291177  1
  P  P195  1  0.349777  0.883047  0.386163  1
  P  P196  1  0.508033  0.875660  0.338544  1
  P  P197  1  0.666682  0.868095  0.291177  1
  P  P198  1  0.166682  0.868095  0.291177  1
  P  P199  1  0.628638  0.578399  0.423706  1
  P  P200  1  0.786894  0.571012  0.376087  1
  P  P201  1  0.945150  0.563625  0.328468  1
  P  P202  1  0.961971  0.245066  0.423706  1
  P  P203  1  0.128638  0.578399  0.423706  1
  P  P204  1  0.286894  0.571012  0.376087  1
  P  P205  1  0.445150  0.563625  0.328468  1
  P  P206  1  0.461971  0.245066  0.423706  1
  P  P207  1  0.620228  0.237679  0.376087  1
  P  P208  1  0.778484  0.230292  0.328468  1
  P  P209  1  0.795305  0.911732  0.423706  1
  P  P210  1  0.953561  0.904346  0.376087  1
  P  P211  1  0.120228  0.237679  0.376087  1
  P  P212  1  0.278484  0.230292  0.328468  1
  P  P213  1  0.295305  0.911732  0.423706  1
  P  P214  1  0.453561  0.904346  0.376087  1
  P  P215  1  0.611817  0.896959  0.328468  1
  P  P216  1  0.111817  0.896959  0.328468  1
  P  P217  1  0.706787  0.507790  0.404605  1
  P  P218  1  0.865043  0.500403  0.356986  1
  P  P219  1  0.023137  0.493812  0.309223  1
  P  P220  1  0.040120  0.174456  0.404605  1
  P  P221  1  0.206787  0.507790  0.404605  1
  P  P222  1  0.365043  0.500403  0.356986  1
  P  P223  1  0.523137  0.493812  0.309223  1
  P  P224  1  0.540120  0.174456  0.404605  1
  P  P225  1  0.698376  0.167069  0.356986  1
  P  P226  1  0.856470  0.160479  0.309223  1
  P  P227  1  0.873453  0.841123  0.404605  1
  P  P228  1  0.031710  0.833736  0.356986  1
  P  P229  1  0.198376  0.167069  0.356986  1
  P  P230  1  0.356470  0.160479  0.309223  1
  P  P231  1  0.373453  0.841123  0.404605  1
  P  P232  1  0.531710  0.833736  0.356986  1
  P  P233  1  0.689804  0.827145  0.309223  1
  P  P234  1  0.189804  0.827145  0.309223  1
  P  P235  1  0.604961  0.620323  0.405264  1
  P  P236  1  0.763217  0.612936  0.357645  1
  P  P237  1  0.921474  0.605550  0.310026  1
  P  P238  1  0.938295  0.286990  0.405264  1
  P  P239  1  0.104961  0.620323  0.405264  1
  P  P240  1  0.263217  0.612936  0.357645  1
  P  P241  1  0.421474  0.605550  0.310026  1
  P  P242  1  0.438295  0.286990  0.405264  1
  P  P243  1  0.596551  0.279603  0.357645  1
  P  P244  1  0.754807  0.272216  0.310026  1
  P  P245  1  0.771628  0.953657  0.405264  1
  P  P246  1  0.929884  0.946270  0.357645  1
  P  P247  1  0.096551  0.279603  0.357645  1
  P  P248  1  0.254807  0.272216  0.310026  1
  P  P249  1  0.271628  0.953657  0.405264  1
  P  P250  1  0.429884  0.946270  0.357645  1
  P  P251  1  0.588140  0.938883  0.310026  1
  P  P252  1  0.088140  0.938883  0.310026  1
  P  P253  1  0.709082  0.569234  0.403439  1
  P  P254  1  0.867338  0.561847  0.355820  1
  P  P255  1  0.025379  0.553833  0.308082  1
  P  P256  1  0.042415  0.235901  0.403439  1
  P  P257  1  0.209082  0.569234  0.403439  1
  P  P258  1  0.367338  0.561847  0.355820  1
  P  P259  1  0.525379  0.553833  0.308082  1
  P  P260  1  0.542415  0.235901  0.403439  1
  P  P261  1  0.700671  0.228514  0.355820  1
  P  P262  1  0.858712  0.220500  0.308082  1
  P  P263  1  0.875748  0.902567  0.403439  1
  P  P264  1  0.034004  0.895180  0.355820  1
  P  P265  1  0.200671  0.228514  0.355820  1
  P  P266  1  0.358712  0.220500  0.308082  1
  P  P267  1  0.375748  0.902567  0.403439  1
  P  P268  1  0.534004  0.895180  0.355820  1
  P  P269  1  0.692046  0.887166  0.308082  1
  P  P270  1  0.192046  0.887166  0.308082  1
  P  P271  1  0.602666  0.558879  0.406430  1
  P  P272  1  0.760923  0.551492  0.358811  1
  P  P273  1  0.919179  0.544105  0.311192  1
  P  P274  1  0.936000  0.225545  0.406430  1
  P  P275  1  0.102666  0.558879  0.406430  1
  P  P276  1  0.260923  0.551492  0.358811  1
  P  P277  1  0.419179  0.544105  0.311192  1
  P  P278  1  0.436000  0.225545  0.406430  1
  P  P279  1  0.594256  0.218159  0.358811  1
  P  P280  1  0.752512  0.210772  0.311192  1
  P  P281  1  0.769333  0.892212  0.406430  1
  P  P282  1  0.927589  0.884825  0.358811  1
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  P  P1296  1  0.254583  0.028568  0.659253  1
