# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   59.15905189
_cell_length_b   38.56626809
_cell_length_c   50.28579965
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   68.45108920
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P576
_cell_volume   106710.182747
_cell_formula_units_Z   576
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  0.987767  0.349588  0.307269  1
  P  P2  1  0.654433  0.349588  0.307269  1
  P  P3  1  0.321100  0.349588  0.307269  1
  P  P4  1  0.018801  0.888290  0.369769  1
  P  P5  1  0.685467  0.888290  0.369769  1
  P  P6  1  0.352134  0.888290  0.369769  1
  P  P7  1  0.961610  0.502512  0.256848  1
  P  P8  1  0.628277  0.502512  0.256848  1
  P  P9  1  0.294943  0.502512  0.256848  1
  P  P10  1  0.992723  0.041062  0.319384  1
  P  P11  1  0.659389  0.041062  0.319384  1
  P  P12  1  0.326056  0.041062  0.319384  1
  P  P13  1  1.000132  0.321699  0.366065  1
  P  P14  1  0.666798  0.321699  0.366065  1
  P  P15  1  0.333465  0.321699  0.366065  1
  P  P16  1  0.969385  0.782381  0.302891  1
  P  P17  1  0.636052  0.782381  0.302891  1
  P  P18  1  0.302718  0.782381  0.302891  1
  P  P19  1  0.011392  0.607653  0.323088  1
  P  P20  1  0.678058  0.607653  0.323088  1
  P  P21  1  0.344725  0.607653  0.323088  1
  P  P22  1  0.980358  0.068951  0.260588  1
  P  P23  1  0.647024  0.068951  0.260588  1
  P  P24  1  0.313691  0.068951  0.260588  1
  P  P25  1  0.040612  0.296019  0.322126  1
  P  P26  1  0.707279  0.296019  0.322126  1
  P  P27  1  0.373945  0.296019  0.322126  1
  P  P28  1  0.008898  0.757363  0.259934  1
  P  P29  1  0.675564  0.757363  0.259934  1
  P  P30  1  0.342231  0.757363  0.259934  1
  P  P31  1  0.970911  0.633333  0.367027  1
  P  P32  1  0.637578  0.633333  0.367027  1
  P  P33  1  0.304244  0.633333  0.367027  1
  P  P34  1  0.939877  0.094631  0.304527  1
  P  P35  1  0.606544  0.094631  0.304527  1
  P  P36  1  0.273211  0.094631  0.304527  1
  P  P37  1  0.997985  0.265937  0.321536  1
  P  P38  1  0.664652  0.265937  0.321536  1
  P  P39  1  0.331318  0.265937  0.321536  1
  P  P40  1  0.967266  0.727959  0.259367  1
  P  P41  1  0.633932  0.727959  0.259367  1
  P  P42  1  0.300599  0.727959  0.259367  1
  P  P43  1  0.013538  0.663415  0.367617  1
  P  P44  1  0.680205  0.663415  0.367617  1
  P  P45  1  0.346872  0.663415  0.367617  1
  P  P46  1  0.982504  0.124714  0.305117  1
  P  P47  1  0.649171  0.124714  0.305117  1
  P  P48  1  0.315838  0.124714  0.305117  1
  P  P49  1  0.094882  0.393150  0.275506  1
  P  P50  1  0.761549  0.393150  0.275506  1
  P  P51  1  0.428216  0.393150  0.275506  1
  P  P52  1  0.125916  0.931851  0.338006  1
  P  P53  1  0.792583  0.931851  0.338006  1
  P  P54  1  0.459250  0.931851  0.338006  1
  P  P55  1  0.854604  0.458726  0.288589  1
  P  P56  1  0.521271  0.458726  0.288589  1
  P  P57  1  0.187938  0.458726  0.288589  1
  P  P58  1  0.885607  0.997501  0.351147  1
  P  P59  1  0.552274  0.997501  0.351147  1
  P  P60  1  0.218940  0.997501  0.351147  1
  P  P61  1  0.052826  0.430139  0.316443  1
  P  P62  1  0.719493  0.430139  0.316443  1
  P  P63  1  0.386160  0.430139  0.316443  1
  P  P64  1  0.022547  0.891169  0.254052  1
  P  P65  1  0.689213  0.891169  0.254052  1
  P  P66  1  0.355880  0.891169  0.254052  1
  P  P67  1  0.958697  0.499213  0.372711  1
  P  P68  1  0.625364  0.499213  0.372711  1
  P  P69  1  0.292030  0.499213  0.372711  1
  P  P70  1  0.927663  0.960512  0.310211  1
  P  P71  1  0.594330  0.960512  0.310211  1
  P  P72  1  0.260996  0.960512  0.310211  1
  P  P73  1  0.103663  0.375242  0.336386  1
  P  P74  1  0.770329  0.375242  0.336386  1
  P  P75  1  0.436996  0.375242  0.336386  1
  P  P76  1  0.072198  0.837565  0.273571  1
  P  P77  1  0.738864  0.837565  0.273571  1
  P  P78  1  0.405531  0.837565  0.273571  1
  P  P79  1  0.907861  0.554110  0.352767  1
  P  P80  1  0.574527  0.554110  0.352767  1
  P  P81  1  0.241194  0.554110  0.352767  1
  P  P82  1  0.876827  0.015408  0.290267  1
  P  P83  1  0.543493  0.015408  0.290267  1
  P  P84  1  0.210160  0.015408  0.290267  1
  P  P85  1  0.097973  0.454431  0.314874  1
  P  P86  1  0.764640  0.454431  0.314874  1
  P  P87  1  0.431307  0.454431  0.314874  1
  P  P88  1  0.066647  0.914901  0.252522  1
  P  P89  1  0.733314  0.914901  0.252522  1
  P  P90  1  0.399981  0.914901  0.252522  1
  P  P91  1  0.913550  0.474921  0.374280  1
  P  P92  1  0.580217  0.474921  0.374280  1
  P  P93  1  0.246883  0.474921  0.374280  1
  P  P94  1  0.882516  0.936219  0.311780  1
  P  P95  1  0.549183  0.936219  0.311780  1
  P  P96  1  0.215849  0.936219  0.311780  1
  P  P97  1  0.913880  0.248233  0.371380  1
  P  P98  1  0.580546  0.248233  0.371380  1
  P  P99  1  0.247213  0.248233  0.371380  1
  P  P100  1  0.882846  0.709532  0.308880  1
  P  P101  1  0.549513  0.709532  0.308880  1
  P  P102  1  0.216179  0.709532  0.308880  1
  P  P103  1  0.097644  0.681119  0.317774  1
  P  P104  1  0.764310  0.681119  0.317774  1
  P  P105  1  0.430977  0.681119  0.317774  1
  P  P106  1  0.067193  0.139679  0.256145  1
  P  P107  1  0.733859  0.139679  0.256145  1
  P  P108  1  0.400526  0.139679  0.256145  1
  P  P109  1  0.847833  0.240425  0.279234  1
  P  P110  1  0.514499  0.240425  0.279234  1
  P  P111  1  0.181166  0.240425  0.279234  1
  P  P112  1  0.880472  0.779447  0.342413  1
  P  P113  1  0.547139  0.779447  0.342413  1
  P  P114  1  0.213806  0.779447  0.342413  1
  P  P115  1  0.100017  0.611204  0.284240  1
  P  P116  1  0.766684  0.611204  0.284240  1
  P  P117  1  0.433350  0.611204  0.284240  1
  P  P118  1  0.131051  0.149905  0.346740  1
  P  P119  1  0.797718  0.149905  0.346740  1
  P  P120  1  0.464384  0.149905  0.346740  1
  P  P121  1  0.802979  0.232783  0.260812  1
  P  P122  1  0.469645  0.232783  0.260812  1
  P  P123  1  0.136312  0.232783  0.260812  1
  P  P124  1  0.832328  0.771262  0.322694  1
  P  P125  1  0.498995  0.771262  0.322694  1
  P  P126  1  0.165661  0.771262  0.322694  1
  P  P127  1  0.148162  0.619388  0.303959  1
  P  P128  1  0.814828  0.619388  0.303959  1
  P  P129  1  0.481495  0.619388  0.303959  1
  P  P130  1  0.179195  0.158090  0.366459  1
  P  P131  1  0.845862  0.158090  0.366459  1
  P  P132  1  0.512529  0.158090  0.366459  1
  P  P133  1  0.898030  0.326906  0.344257  1
  P  P134  1  0.564697  0.326906  0.344257  1
  P  P135  1  0.231363  0.326906  0.344257  1
  P  P136  1  0.866996  0.788205  0.281757  1
  P  P137  1  0.533663  0.788205  0.281757  1
  P  P138  1  0.200329  0.788205  0.281757  1
  P  P139  1  0.113493  0.602446  0.344897  1
  P  P140  1  0.780160  0.602446  0.344897  1
  P  P141  1  0.446827  0.602446  0.344897  1
  P  P142  1  0.081955  0.066384  0.281464  1
  P  P143  1  0.748622  0.066384  0.281464  1
  P  P144  1  0.415288  0.066384  0.281464  1
  P  P145  1  0.049834  0.426991  0.432269  1
  P  P146  1  0.716501  0.426991  0.432269  1
  P  P147  1  0.383168  0.426991  0.432269  1
  P  P148  1  0.080868  0.965693  0.494769  1
  P  P149  1  0.747535  0.965693  0.494769  1
  P  P150  1  0.414202  0.965693  0.494769  1
  P  P151  1  0.023757  0.579763  0.381884  1
  P  P152  1  0.690423  0.579763  0.381884  1
  P  P153  1  0.357090  0.579763  0.381884  1
  P  P154  1  0.054790  0.118465  0.444384  1
  P  P155  1  0.721457  0.118465  0.444384  1
  P  P156  1  0.388124  0.118465  0.444384  1
  P  P157  1  0.062199  0.399102  0.491065  1
  P  P158  1  0.728866  0.399102  0.491065  1
  P  P159  1  0.395533  0.399102  0.491065  1
  P  P160  1  0.031165  0.860401  0.428565  1
  P  P161  1  0.697832  0.860401  0.428565  1
  P  P162  1  0.364499  0.860401  0.428565  1
  P  P163  1  0.073459  0.685055  0.448088  1
  P  P164  1  0.740126  0.685055  0.448088  1
  P  P165  1  0.406793  0.685055  0.448088  1
  P  P166  1  0.042425  0.146354  0.385588  1
  P  P167  1  0.709092  0.146354  0.385588  1
  P  P168  1  0.375759  0.146354  0.385588  1
  P  P169  1  0.102680  0.373422  0.447126  1
  P  P170  1  0.769346  0.373422  0.447126  1
  P  P171  1  0.436013  0.373422  0.447126  1
  P  P172  1  0.071646  0.834721  0.384626  1
  P  P173  1  0.738313  0.834721  0.384626  1
  P  P174  1  0.404979  0.834721  0.384626  1
  P  P175  1  0.032979  0.710735  0.492027  1
  P  P176  1  0.699645  0.710735  0.492027  1
  P  P177  1  0.366312  0.710735  0.492027  1
  P  P178  1  0.001945  0.172034  0.429527  1
  P  P179  1  0.668612  0.172034  0.429527  1
  P  P180  1  0.335278  0.172034  0.429527  1
  P  P181  1  0.060053  0.343339  0.446536  1
  P  P182  1  0.726719  0.343339  0.446536  1
  P  P183  1  0.393386  0.343339  0.446536  1
  P  P184  1  0.029019  0.804638  0.384036  1
  P  P185  1  0.695685  0.804638  0.384036  1
  P  P186  1  0.362352  0.804638  0.384036  1
  P  P187  1  0.075606  0.740818  0.492617  1
  P  P188  1  0.742273  0.740818  0.492617  1
  P  P189  1  0.408939  0.740818  0.492617  1
  P  P190  1  0.044572  0.202116  0.430117  1
  P  P191  1  0.711239  0.202116  0.430117  1
  P  P192  1  0.377905  0.202116  0.430117  1
  P  P193  1  0.156950  0.470552  0.400506  1
  P  P194  1  0.823617  0.470552  0.400506  1
  P  P195  1  0.490283  0.470552  0.400506  1
  P  P196  1  0.187984  0.009254  0.463006  1
  P  P197  1  0.854651  0.009254  0.463006  1
  P  P198  1  0.521317  0.009254  0.463006  1
  P  P199  1  0.916641  0.536202  0.413647  1
  P  P200  1  0.583307  0.536202  0.413647  1
  P  P201  1  0.249974  0.536202  0.413647  1
  P  P202  1  0.947675  0.074904  0.476147  1
  P  P203  1  0.614341  0.074904  0.476147  1
  P  P204  1  0.281008  0.074904  0.476147  1
  P  P205  1  0.114894  0.507542  0.441443  1
  P  P206  1  0.781561  0.507542  0.441443  1
  P  P207  1  0.448227  0.507542  0.441443  1
  P  P208  1  0.083860  0.968840  0.378943  1
  P  P209  1  0.750527  0.968840  0.378943  1
  P  P210  1  0.417194  0.968840  0.378943  1
  P  P211  1  0.020765  0.576616  0.497711  1
  P  P212  1  0.687431  0.576616  0.497711  1
  P  P213  1  0.354098  0.576616  0.497711  1
  P  P214  1  0.989731  0.037914  0.435211  1
  P  P215  1  0.656397  0.037914  0.435211  1
  P  P216  1  0.323064  0.037914  0.435211  1
  P  P217  1  0.165730  0.452645  0.461386  1
  P  P218  1  0.832397  0.452645  0.461386  1
  P  P219  1  0.499064  0.452645  0.461386  1
  P  P220  1  0.134697  0.913944  0.398886  1
  P  P221  1  0.801363  0.913944  0.398886  1
  P  P222  1  0.468030  0.913944  0.398886  1
  P  P223  1  0.969928  0.631512  0.477767  1
  P  P224  1  0.636595  0.631512  0.477767  1
  P  P225  1  0.303262  0.631512  0.477767  1
  P  P226  1  0.938894  0.092811  0.415267  1
  P  P227  1  0.605561  0.092811  0.415267  1
  P  P228  1  0.272228  0.092811  0.415267  1
  P  P229  1  0.160041  0.531834  0.439874  1
  P  P230  1  0.826708  0.531834  0.439874  1
  P  P231  1  0.493374  0.531834  0.439874  1
  P  P232  1  0.129007  0.993133  0.377374  1
  P  P233  1  0.795674  0.993133  0.377374  1
  P  P234  1  0.462340  0.993133  0.377374  1
  P  P235  1  0.975618  0.552323  0.499280  1
  P  P236  1  0.642284  0.552323  0.499280  1
  P  P237  1  0.308951  0.552323  0.499280  1
  P  P238  1  0.944584  0.013622  0.436780  1
  P  P239  1  0.611250  0.013622  0.436780  1
  P  P240  1  0.277917  0.013622  0.436780  1
  P  P241  1  0.975947  0.325636  0.496380  1
  P  P242  1  0.642614  0.325636  0.496380  1
  P  P243  1  0.309281  0.325636  0.496380  1
  P  P244  1  0.944914  0.786934  0.433880  1
  P  P245  1  0.611580  0.786934  0.433880  1
  P  P246  1  0.278247  0.786934  0.433880  1
  P  P247  1  0.159711  0.758522  0.442774  1
  P  P248  1  0.826378  0.758522  0.442774  1
  P  P249  1  0.493045  0.758522  0.442774  1
  P  P250  1  0.128677  0.219820  0.380274  1
  P  P251  1  0.795344  0.219820  0.380274  1
  P  P252  1  0.462011  0.219820  0.380274  1
  P  P253  1  0.911506  0.318148  0.404913  1
  P  P254  1  0.578173  0.318148  0.404913  1
  P  P255  1  0.244840  0.318148  0.404913  1
  P  P256  1  0.942540  0.856849  0.467413  1
  P  P257  1  0.609207  0.856849  0.467413  1
  P  P258  1  0.275873  0.856849  0.467413  1
  P  P259  1  0.162085  0.688607  0.409240  1
  P  P260  1  0.828751  0.688607  0.409240  1
  P  P261  1  0.495418  0.688607  0.409240  1
  P  P262  1  0.193119  0.227308  0.471740  1
  P  P263  1  0.859785  0.227308  0.471740  1
  P  P264  1  0.526452  0.227308  0.471740  1
  P  P265  1  0.863362  0.309964  0.385194  1
  P  P266  1  0.530028  0.309964  0.385194  1
  P  P267  1  0.196695  0.309964  0.385194  1
  P  P268  1  0.894396  0.848665  0.447694  1
  P  P269  1  0.561062  0.848665  0.447694  1
  P  P270  1  0.227729  0.848665  0.447694  1
  P  P271  1  0.210229  0.696791  0.428959  1
  P  P272  1  0.876896  0.696791  0.428959  1
  P  P273  1  0.543563  0.696791  0.428959  1
  P  P274  1  0.241263  0.235492  0.491459  1
  P  P275  1  0.907930  0.235492  0.491459  1
  P  P276  1  0.574596  0.235492  0.491459  1
  P  P277  1  0.960098  0.404309  0.469257  1
  P  P278  1  0.626764  0.404309  0.469257  1
  P  P279  1  0.293431  0.404309  0.469257  1
  P  P280  1  0.929064  0.865607  0.406757  1
  P  P281  1  0.595730  0.865607  0.406757  1
  P  P282  1  0.262397  0.865607  0.406757  1
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  P  P575  1  0.935329  0.295953  0.657397  1
  P  P576  1  0.601996  0.295953  0.657397  1
