# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   31.01502179
_cell_length_b   87.01003628
_cell_length_c   52.29074622
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   96.80927590
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P1512
_cell_volume   140117.394546
_cell_formula_units_Z   1512
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  0.262101  0.934676  0.299335  1
  P  P2  1  0.447300  0.919373  0.396670  1
  P  P3  1  0.854974  0.927187  0.347764  1
  P  P4  1  0.762101  0.434676  0.299335  1
  P  P5  1  0.947300  0.419373  0.396670  1
  P  P6  1  0.354974  0.427187  0.347764  1
  P  P7  1  0.137469  0.919712  0.419911  1
  P  P8  1  0.545243  0.928531  0.370652  1
  P  P9  1  0.952602  0.936548  0.321511  1
  P  P10  1  0.637469  0.419712  0.419911  1
  P  P11  1  0.045243  0.428531  0.370652  1
  P  P12  1  0.452602  0.436548  0.321511  1
  P  P13  1  0.714361  0.611389  0.400614  1
  P  P14  1  0.123412  0.618517  0.353602  1
  P  P15  1  0.486742  0.654013  0.291481  1
  P  P16  1  0.214361  0.111389  0.400614  1
  P  P17  1  0.623412  0.118517  0.353602  1
  P  P18  1  0.986742  0.154013  0.291481  1
  P  P19  1  1.001849  0.695628  0.421961  1
  P  P20  1  0.410635  0.702710  0.374285  1
  P  P21  1  0.821553  0.711636  0.327896  1
  P  P22  1  0.501849  0.195628  0.421961  1
  P  P23  1  0.910635  0.202710  0.374285  1
  P  P24  1  0.321553  0.211636  0.327896  1
  P  P25  1  0.025597  0.713013  0.304051  1
  P  P26  1  0.206683  0.698765  0.397595  1
  P  P27  1  0.617454  0.707127  0.352516  1
  P  P28  1  0.525597  0.213013  0.304051  1
  P  P29  1  0.706683  0.198765  0.397595  1
  P  P30  1  0.117454  0.207127  0.352516  1
  P  P31  1  0.253121  0.924164  0.360195  1
  P  P32  1  0.659811  0.933405  0.310953  1
  P  P33  1  0.845014  0.917322  0.409061  1
  P  P34  1  0.753121  0.424164  0.360195  1
  P  P35  1  0.159811  0.433405  0.310953  1
  P  P36  1  0.345014  0.417322  0.409061  1
  P  P37  1  0.887138  0.736570  0.360568  1
  P  P38  1  0.295237  0.740535  0.308477  1
  P  P39  1  0.475819  0.728180  0.407052  1
  P  P40  1  0.387138  0.236570  0.360568  1
  P  P41  1  0.795237  0.240535  0.308477  1
  P  P42  1  0.975819  0.228180  0.407052  1
  P  P43  1  0.916499  0.615136  0.373074  1
  P  P44  1  0.330845  0.621715  0.331889  1
  P  P45  1  0.509455  0.607316  0.424759  1
  P  P46  1  0.416499  0.115136  0.373074  1
  P  P47  1  0.830845  0.121715  0.331889  1
  P  P48  1  0.009455  0.107316  0.424759  1
  P  P49  1  0.003751  0.732379  0.408541  1
  P  P50  1  0.410659  0.739153  0.358291  1
  P  P51  1  0.820789  0.748457  0.317189  1
  P  P52  1  0.503751  0.232379  0.408541  1
  P  P53  1  0.910659  0.239153  0.358291  1
  P  P54  1  0.320789  0.248457  0.317189  1
  P  P55  1  0.106327  0.734200  0.396226  1
  P  P56  1  0.514747  0.742051  0.352362  1
  P  P57  1  0.923257  0.750401  0.305528  1
  P  P58  1  0.606327  0.234200  0.396226  1
  P  P59  1  0.014747  0.242051  0.352362  1
  P  P60  1  0.423257  0.250401  0.305528  1
  P  P61  1  0.834747  0.705065  0.389329  1
  P  P62  1  0.242822  0.710703  0.339116  1
  P  P63  1  0.656282  0.720250  0.296646  1
  P  P64  1  0.334747  0.205065  0.389329  1
  P  P65  1  0.742822  0.210703  0.339116  1
  P  P66  1  0.156282  0.220250  0.296646  1
  P  P67  1  0.693603  0.486587  0.317762  1
  P  P68  1  0.877318  0.475773  0.419729  1
  P  P69  1  0.285799  0.483996  0.370258  1
  P  P70  1  0.193603  0.986587  0.317762  1
  P  P71  1  0.377318  0.975773  0.419729  1
  P  P72  1  0.785799  0.983996  0.370258  1
  P  P73  1  0.008867  0.870928  0.359710  1
  P  P74  1  0.414989  0.880039  0.312123  1
  P  P75  1  0.603863  0.862316  0.409156  1
  P  P76  1  0.508867  0.370928  0.359710  1
  P  P77  1  0.914989  0.380039  0.312123  1
  P  P78  1  0.103863  0.362316  0.409156  1
  P  P79  1  0.662143  0.511719  0.359513  1
  P  P80  1  0.050937  0.522474  0.317824  1
  P  P81  1  0.245059  0.506379  0.411992  1
  P  P82  1  0.162143  0.011719  0.359513  1
  P  P83  1  0.550937  0.022474  0.317824  1
  P  P84  1  0.745059  0.006379  0.411992  1
  P  P85  1  0.219402  0.874659  0.337181  1
  P  P86  1  0.628023  0.882897  0.290199  1
  P  P87  1  0.808472  0.865870  0.384870  1
  P  P88  1  0.719402  0.374659  0.337181  1
  P  P89  1  0.128023  0.382897  0.290199  1
  P  P90  1  0.308472  0.365870  0.384870  1
  P  P91  1  0.357128  0.769476  0.328847  1
  P  P92  1  0.471916  0.764356  0.394429  1
  P  P93  1  0.887781  0.772981  0.348726  1
  P  P94  1  0.857128  0.269476  0.328847  1
  P  P95  1  0.971916  0.264356  0.394429  1
  P  P96  1  0.387781  0.272981  0.348726  1
  P  P97  1  0.038781  0.708348  0.364712  1
  P  P98  1  0.451981  0.715815  0.317800  1
  P  P99  1  0.630422  0.701411  0.413827  1
  P  P100  1  0.538781  0.208348  0.364712  1
  P  P101  1  0.951981  0.215815  0.317800  1
  P  P102  1  0.130422  0.201411  0.413827  1
  P  P103  1  0.764870  0.642134  0.370413  1
  P  P104  1  0.175101  0.648553  0.323427  1
  P  P105  1  0.356035  0.633777  0.418246  1
  P  P106  1  0.264870  0.142134  0.370413  1
  P  P107  1  0.675101  0.148553  0.323427  1
  P  P108  1  0.856035  0.133777  0.418246  1
  P  P109  1  0.146864  0.929773  0.359161  1
  P  P110  1  0.555089  0.938517  0.310180  1
  P  P111  1  0.739766  0.922669  0.407703  1
  P  P112  1  0.646864  0.429773  0.359161  1
  P  P113  1  0.055089  0.438517  0.310180  1
  P  P114  1  0.239766  0.422669  0.407703  1
  P  P115  1  0.713477  0.447720  0.402535  1
  P  P116  1  0.120405  0.456991  0.352856  1
  P  P117  1  0.528335  0.464557  0.304500  1
  P  P118  1  0.213477  0.947720  0.402535  1
  P  P119  1  0.620405  0.956991  0.352856  1
  P  P120  1  0.028335  0.964557  0.304500  1
  P  P121  1  0.390290  0.913302  0.293553  1
  P  P122  1  0.575254  0.895139  0.389682  1
  P  P123  1  0.981252  0.903957  0.341963  1
  P  P124  1  0.890290  0.413302  0.293553  1
  P  P125  1  0.075254  0.395139  0.389682  1
  P  P126  1  0.481252  0.403957  0.341963  1
  P  P127  1  0.243080  0.914545  0.421345  1
  P  P128  1  0.650500  0.923377  0.371688  1
  P  P129  1  0.058227  0.930224  0.321996  1
  P  P130  1  0.743080  0.414545  0.421345  1
  P  P131  1  0.150500  0.423377  0.371688  1
  P  P132  1  0.558227  0.430224  0.321996  1
  P  P133  1  0.904006  0.655010  0.303548  1
  P  P134  1  0.086427  0.641800  0.396131  1
  P  P135  1  0.497698  0.649782  0.351426  1
  P  P136  1  0.404006  0.155010  0.303548  1
  P  P137  1  0.586427  0.141800  0.396131  1
  P  P138  1  0.997698  0.149782  0.351426  1
  P  P139  1  0.989893  0.738396  0.347636  1
  P  P140  1  0.400065  0.743551  0.297395  1
  P  P141  1  0.579724  0.730621  0.396130  1
  P  P142  1  0.489893  0.238396  0.347636  1
  P  P143  1  0.900065  0.243551  0.297395  1
  P  P144  1  0.079724  0.230621  0.396130  1
  P  P145  1  0.020607  0.616382  0.366654  1
  P  P146  1  0.434021  0.624122  0.320540  1
  P  P147  1  0.612177  0.609095  0.413968  1
  P  P148  1  0.520607  0.116382  0.366654  1
  P  P149  1  0.934021  0.124122  0.320540  1
  P  P150  1  0.112177  0.109095  0.413968  1
  P  P151  1  0.007330  0.659165  0.291799  1
  P  P152  1  0.189561  0.643326  0.384659  1
  P  P153  1  0.598979  0.651872  0.338637  1
  P  P154  1  0.507330  0.159165  0.291799  1
  P  P155  1  0.689561  0.143326  0.384659  1
  P  P156  1  0.098979  0.151872  0.338637  1
  P  P157  1  0.850056  0.508423  0.400337  1
  P  P158  1  0.256695  0.516450  0.351267  1
  P  P159  1  0.683748  0.519733  0.301175  1
  P  P160  1  0.350056  0.008423  0.400337  1
  P  P161  1  0.756695  0.016450  0.351267  1
  P  P162  1  0.183748  0.019733  0.301175  1
  P  P163  1  0.815617  0.613595  0.384240  1
  P  P164  1  0.226522  0.620081  0.342372  1
  P  P165  1  0.589262  0.657780  0.279465  1
  P  P166  1  0.315617  0.113595  0.384240  1
  P  P167  1  0.726522  0.120081  0.342372  1
  P  P168  1  0.089262  0.157780  0.279465  1
  P  P169  1  0.816801  0.468847  0.314982  1
  P  P170  1  0.005812  0.452136  0.412807  1
  P  P171  1  0.414213  0.459744  0.364105  1
  P  P172  1  0.316801  0.968847  0.314982  1
  P  P173  1  0.505812  0.952136  0.412807  1
  P  P174  1  0.914213  0.959744  0.364105  1
  P  P175  1  0.786689  0.503010  0.299241  1
  P  P176  1  0.974299  0.485490  0.394352  1
  P  P177  1  0.384780  0.492623  0.346169  1
  P  P178  1  0.286689  0.003010  0.299241  1
  P  P179  1  0.474299  0.985490  0.394352  1
  P  P180  1  0.884780  0.992623  0.346169  1
  P  P181  1  0.129132  0.715211  0.293333  1
  P  P182  1  0.308718  0.700510  0.385560  1
  P  P183  1  0.720196  0.708996  0.340550  1
  P  P184  1  0.629132  0.215211  0.293333  1
  P  P185  1  0.808718  0.200510  0.385560  1
  P  P186  1  0.220196  0.208996  0.340550  1
  P  P187  1  0.730566  0.665867  0.414955  1
  P  P188  1  0.139760  0.672757  0.366189  1
  P  P189  1  0.550262  0.681397  0.320277  1
  P  P190  1  0.230566  0.165867  0.414955  1
  P  P191  1  0.639760  0.172757  0.366189  1
  P  P192  1  0.050262  0.181397  0.320277  1
  P  P193  1  0.644112  0.504078  0.422097  1
  P  P194  1  0.047956  0.512682  0.375936  1
  P  P195  1  0.457729  0.520519  0.327595  1
  P  P196  1  0.144112  0.004078  0.422097  1
  P  P197  1  0.547956  0.012682  0.375936  1
  P  P198  1  0.957729  0.020519  0.327595  1
  P  P199  1  0.176896  0.896468  0.378044  1
  P  P200  1  0.584286  0.905222  0.328564  1
  P  P201  1  0.769385  0.888887  0.426413  1
  P  P202  1  0.676896  0.396468  0.378044  1
  P  P203  1  0.084286  0.405222  0.328564  1
  P  P204  1  0.269385  0.388887  0.426413  1
  P  P205  1  0.195171  0.741032  0.323592  1
  P  P206  1  0.374468  0.728334  0.416089  1
  P  P207  1  0.784966  0.734667  0.372786  1
  P  P208  1  0.695171  0.241032  0.323592  1
  P  P209  1  0.874468  0.228334  0.416089  1
  P  P210  1  0.284966  0.234667  0.372786  1
  P  P211  1  0.901814  0.731066  0.421278  1
  P  P212  1  0.309151  0.736254  0.369182  1
  P  P213  1  0.718193  0.746023  0.327736  1
  P  P214  1  0.401814  0.231066  0.421278  1
  P  P215  1  0.809151  0.236254  0.369182  1
  P  P216  1  0.218193  0.246023  0.327736  1
  P  P217  1  0.969912  0.645399  0.346295  1
  P  P218  1  0.381987  0.652203  0.301394  1
  P  P219  1  0.561915  0.638219  0.395420  1
  P  P220  1  0.469912  0.145399  0.346295  1
  P  P221  1  0.881987  0.152203  0.301394  1
  P  P222  1  0.061915  0.138219  0.395420  1
  P  P223  1  0.141258  0.709837  0.353020  1
  P  P224  1  0.553966  0.718575  0.307620  1
  P  P225  1  0.732554  0.703146  0.401801  1
  P  P226  1  0.641258  0.209837  0.353020  1
  P  P227  1  0.053966  0.218575  0.307620  1
  P  P228  1  0.232554  0.203146  0.401801  1
  P  P229  1  0.615749  0.462691  0.339519  1
  P  P230  1  0.024806  0.471331  0.292819  1
  P  P231  1  0.209914  0.456168  0.388532  1
  P  P232  1  0.115749  0.962691  0.339519  1
  P  P233  1  0.524806  0.971331  0.292819  1
  P  P234  1  0.709914  0.956168  0.388532  1
  P  P235  1  0.088520  0.897451  0.342226  1
  P  P236  1  0.492908  0.906473  0.295393  1
  P  P237  1  0.680913  0.889915  0.391319  1
  P  P238  1  0.588520  0.397451  0.342226  1
  P  P239  1  0.992908  0.406473  0.295393  1
  P  P240  1  0.180913  0.389915  0.391319  1
  P  P241  1  0.935585  0.670686  0.390478  1
  P  P242  1  0.344546  0.676063  0.343098  1
  P  P243  1  0.757557  0.684542  0.298864  1
  P  P244  1  0.435585  0.170686  0.390478  1
  P  P245  1  0.844546  0.176063  0.343098  1
  P  P246  1  0.257557  0.184542  0.298864  1
  P  P247  1  0.349304  0.935583  0.334518  1
  P  P248  1  0.758778  0.941857  0.287512  1
  P  P249  1  0.942951  0.926596  0.383520  1
  P  P250  1  0.849304  0.435583  0.334518  1
  P  P251  1  0.258778  0.441857  0.287512  1
  P  P252  1  0.442951  0.426596  0.383520  1
  P  P253  1  0.849450  0.620757  0.323348  1
  P  P254  1  0.974303  0.604257  0.421134  1
  P  P255  1  0.397219  0.611176  0.375808  1
  P  P256  1  0.349450  0.120757  0.323348  1
  P  P257  1  0.474303  0.104257  0.421134  1
  P  P258  1  0.897219  0.111176  0.375808  1
  P  P259  1  0.072265  0.646997  0.334829  1
  P  P260  1  0.252803  0.631740  0.429731  1
  P  P261  1  0.663398  0.640158  0.383017  1
  P  P262  1  0.572265  0.146997  0.334829  1
  P  P263  1  0.752803  0.131740  0.429731  1
  P  P264  1  0.163398  0.140158  0.383017  1
  P  P265  1  0.509510  0.444287  0.426007  1
  P  P266  1  0.916892  0.452728  0.377192  1
  P  P267  1  0.325458  0.460442  0.328388  1
  P  P268  1  0.009510  0.944287  0.426007  1
  P  P269  1  0.416892  0.952728  0.377192  1
  P  P270  1  0.825458  0.960442  0.328388  1
  P  P271  1  0.778914  0.491517  0.357776  1
  P  P272  1  0.191372  0.499024  0.309020  1
  P  P273  1  0.374903  0.483442  0.406700  1
  P  P274  1  0.278914  0.991517  0.357776  1
  P  P275  1  0.691372  0.999024  0.309020  1
  P  P276  1  0.874903  0.983442  0.406700  1
  P  P277  1  0.049107  0.920819  0.383806  1
  P  P278  1  0.456644  0.929994  0.335441  1
  P  P279  1  0.862819  0.937072  0.287770  1
  P  P280  1  0.549107  0.420819  0.383806  1
  P  P281  1  0.956644  0.429994  0.335441  1
  P  P282  1  0.362819  0.437072  0.287770  1
  P  P283  1  0.971064  0.682525  0.332760  1
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  P  P1431  1  0.429773  0.835928  0.717713  1
  P  P1432  1  0.340645  0.344329  0.671697  1
  P  P1433  1  0.743874  0.351745  0.624093  1
  P  P1434  1  0.929773  0.335928  0.717713  1
  P  P1435  1  0.570155  0.706910  0.574324  1
  P  P1436  1  0.750693  0.691653  0.669227  1
  P  P1437  1  0.159561  0.698492  0.621039  1
  P  P1438  1  0.070155  0.206910  0.574324  1
  P  P1439  1  0.250693  0.191653  0.669227  1
  P  P1440  1  0.659561  0.198492  0.621039  1
  P  P1441  1  0.163147  0.405245  0.693103  1
  P  P1442  1  0.569837  0.414486  0.643861  1
  P  P1443  1  0.977944  0.421327  0.594995  1
  P  P1444  1  0.663147  0.905245  0.693103  1
  P  P1445  1  0.069837  0.914486  0.643861  1
  P  P1446  1  0.477944  0.921327  0.594995  1
  P  P1447  1  0.451102  0.447752  0.589589  1
  P  P1448  1  0.635251  0.431529  0.686648  1
  P  P1449  1  0.043203  0.439230  0.637914  1
  P  P1450  1  0.951102  0.947752  0.589589  1
  P  P1451  1  0.135251  0.931529  0.686648  1
  P  P1452  1  0.543203  0.939230  0.637914  1
  P  P1453  1  0.422893  0.595099  0.706660  1
  P  P1454  1  0.833065  0.600254  0.656420  1
  P  P1455  1  0.243234  0.608029  0.607926  1
  P  P1456  1  0.922893  0.095099  0.706660  1
  P  P1457  1  0.333065  0.100254  0.656420  1
  P  P1458  1  0.743234  0.108029  0.607926  1
  P  P1459  1  0.464260  0.667423  0.599219  1
  P  P1460  1  0.645996  0.653644  0.694746  1
  P  P1461  1  0.054319  0.659680  0.645880  1
  P  P1462  1  0.964260  0.167423  0.599219  1
  P  P1463  1  0.145996  0.153644  0.694746  1
  P  P1464  1  0.554319  0.159680  0.645880  1
  P  P1465  1  0.370977  0.622835  0.686256  1
  P  P1466  1  0.784178  0.630302  0.639343  1
  P  P1467  1  0.192536  0.637239  0.590229  1
  P  P1468  1  0.870977  0.122835  0.686256  1
  P  P1469  1  0.284178  0.130302  0.639343  1
  P  P1470  1  0.692536  0.137239  0.590229  1
  P  P1471  1  0.330050  0.432176  0.708662  1
  P  P1472  1  0.734438  0.441199  0.661830  1
  P  P1473  1  0.142045  0.448734  0.612737  1
  P  P1474  1  0.830050  0.932176  0.708662  1
  P  P1475  1  0.234438  0.941199  0.661830  1
  P  P1476  1  0.642045  0.948734  0.612737  1
  P  P1477  1  0.412323  0.635940  0.629771  1
  P  P1478  1  0.821110  0.643022  0.582094  1
  P  P1479  1  1.001405  0.627014  0.676160  1
  P  P1480  1  0.912323  0.135940  0.629771  1
  P  P1481  1  0.321110  0.143022  0.582094  1
  P  P1482  1  0.501405  0.127014  0.676160  1
  P  P1483  1  0.481307  0.413898  0.608139  1
  P  P1484  1  0.665027  0.398505  0.704721  1
  P  P1485  1  0.073260  0.405841  0.656960  1
  P  P1486  1  0.981307  0.913898  0.608139  1
  P  P1487  1  0.165027  0.898505  0.704721  1
  P  P1488  1  0.573260  0.905841  0.656960  1
  P  P1489  1  0.412299  0.599497  0.645764  1
  P  P1490  1  0.819207  0.606271  0.595515  1
  P  P1491  1  0.002169  0.590193  0.686867  1
  P  P1492  1  0.912299  0.099497  0.645764  1
  P  P1493  1  0.319207  0.106271  0.595515  1
  P  P1494  1  0.502169  0.090193  0.686867  1
  P  P1495  1  0.388938  0.714528  0.683516  1
  P  P1496  1  0.802351  0.722268  0.637401  1
  P  P1497  1  0.210781  0.729555  0.590088  1
  P  P1498  1  0.888938  0.214528  0.683516  1
  P  P1499  1  0.302351  0.222268  0.637401  1
  P  P1500  1  0.710781  0.229555  0.590088  1
  P  P1501  1  0.699546  0.720133  0.650453  1
  P  P1502  1  0.108597  0.727261  0.603441  1
  P  P1503  1  0.336216  0.684637  0.712575  1
  P  P1504  1  0.199546  0.220133  0.650453  1
  P  P1505  1  0.608597  0.227261  0.603441  1
  P  P1506  1  0.836216  0.184637  0.712575  1
  P  P1507  1  0.478413  0.662587  0.660958  1
  P  P1508  1  0.887374  0.667963  0.613577  1
  P  P1509  1  0.065401  0.654107  0.705192  1
  P  P1510  1  0.978413  0.162587  0.660958  1
  P  P1511  1  0.387374  0.167963  0.613577  1
  P  P1512  1  0.565401  0.154107  0.705192  1
