# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   26.73301440
_cell_length_b   46.12496685
_cell_length_c   50.88812095
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   80.39530568
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P576
_cell_volume   61868.4967461
_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  0.976667  0.625288  0.439518  1
  P  P2  1  0.310000  0.291955  0.439518  1
  P  P3  1  0.370199  0.658292  0.404848  1
  P  P4  1  0.790553  0.656260  0.382762  1
  P  P5  1  0.123886  0.322927  0.382762  1
  P  P6  1  0.457219  0.989594  0.382762  1
  P  P7  1  0.643334  0.958621  0.439518  1
  P  P8  1  0.703533  0.324959  0.404848  1
  P  P9  1  0.036866  0.991625  0.404848  1
  P  P10  1  0.948495  0.565423  0.428972  1
  P  P11  1  0.281828  0.232090  0.428972  1
  P  P12  1  0.375742  0.587054  0.405020  1
  P  P13  1  0.757485  0.596327  0.360956  1
  P  P14  1  0.090818  0.262994  0.360956  1
  P  P15  1  0.424151  0.929660  0.360956  1
  P  P16  1  0.615162  0.898756  0.428972  1
  P  P17  1  0.709075  0.253720  0.405020  1
  P  P18  1  0.042408  0.920387  0.405020  1
  P  P19  1  0.073570  0.704821  0.415119  1
  P  P20  1  0.406903  0.371487  0.415119  1
  P  P21  1  0.421201  0.707770  0.376161  1
  P  P22  1  0.732271  0.674292  0.437766  1
  P  P23  1  0.065605  0.340958  0.437766  1
  P  P24  1  0.398938  0.007625  0.437766  1
  P  P25  1  0.740237  0.038154  0.415119  1
  P  P26  1  0.754534  0.374436  0.376161  1
  P  P27  1  0.087867  0.041103  0.376161  1
  P  P28  1  0.042519  0.583051  0.394111  1
  P  P29  1  0.375852  0.249718  0.394111  1
  P  P30  1  0.367622  0.554478  0.461651  1
  P  P31  1  0.710632  0.553608  0.400310  1
  P  P32  1  0.043965  0.220275  0.400310  1
  P  P33  1  0.377299  0.886941  0.400310  1
  P  P34  1  0.709186  0.916384  0.394111  1
  P  P35  1  0.700955  0.221145  0.461651  1
  P  P36  1  0.034288  0.887811  0.461651  1
  P  P37  1  0.298529  0.710487  0.372523  1
  P  P38  1  0.631862  0.377153  0.372523  1
  P  P39  1  0.543025  0.743016  0.449794  1
  P  P40  1  0.968402  0.692851  0.434832  1
  P  P41  1  0.301736  0.359517  0.434832  1
  P  P42  1  0.635069  0.026184  0.434832  1
  P  P43  1  0.965196  0.043820  0.372523  1
  P  P44  1  0.876358  0.409683  0.449794  1
  P  P45  1  0.209692  0.076350  0.449794  1
  P  P46  1  0.280589  0.553945  0.418025  1
  P  P47  1  0.613922  0.220612  0.418025  1
  P  P48  1  0.658375  0.564446  0.346118  1
  P  P49  1  0.924266  0.499851  0.422654  1
  P  P50  1  0.257599  0.166518  0.422654  1
  P  P51  1  0.590933  0.833185  0.422654  1
  P  P52  1  0.947256  0.887279  0.418025  1
  P  P53  1  0.991708  0.231113  0.346118  1
  P  P54  1  0.325042  0.897779  0.346118  1
  P  P55  1  0.063329  0.848882  0.407386  1
  P  P56  1  0.396662  0.515549  0.407386  1
  P  P57  1  0.439391  0.861112  0.349625  1
  P  P58  1  0.716485  0.849376  0.413562  1
  P  P59  1  0.049818  0.516043  0.413562  1
  P  P60  1  0.383151  0.182710  0.413562  1
  P  P61  1  0.729996  0.182216  0.407386  1
  P  P62  1  0.772724  0.527779  0.349625  1
  P  P63  1  0.106057  0.194446  0.349625  1
  P  P64  1  0.988475  0.758752  0.440233  1
  P  P65  1  0.321809  0.425418  0.440233  1
  P  P66  1  0.351183  0.731802  0.427189  1
  P  P67  1  0.771450  0.723700  0.399036  1
  P  P68  1  0.104784  0.390367  0.399036  1
  P  P69  1  0.438117  0.057034  0.399036  1
  P  P70  1  0.655142  0.092085  0.440233  1
  P  P71  1  0.684516  0.398469  0.427189  1
  P  P72  1  0.017850  0.065136  0.427189  1
  P  P73  1  0.182196  0.824731  0.400237  1
  P  P74  1  0.515530  0.491398  0.400237  1
  P  P75  1  0.553300  0.831564  0.360133  1
  P  P76  1  0.806607  0.839875  0.459187  1
  P  P77  1  0.139941  0.506542  0.459187  1
  P  P78  1  0.473274  0.173208  0.459187  1
  P  P79  1  0.848863  0.158065  0.400237  1
  P  P80  1  0.886634  0.498230  0.360133  1
  P  P81  1  0.219967  0.164897  0.360133  1
  P  P82  1  0.234418  0.759678  0.412515  1
  P  P83  1  0.567751  0.426345  0.412515  1
  P  P84  1  0.561860  0.774070  0.395581  1
  P  P85  1  0.874305  0.745354  0.420875  1
  P  P86  1  0.207638  0.412020  0.420875  1
  P  P87  1  0.540972  0.078687  0.420875  1
  P  P88  1  0.901084  0.093012  0.412515  1
  P  P89  1  0.895193  0.440737  0.395581  1
  P  P90  1  0.228526  0.107403  0.395581  1
  P  P91  1  0.139270  0.885224  0.372038  1
  P  P92  1  0.472603  0.551890  0.372038  1
  P  P93  1  0.469908  0.827044  0.406023  1
  P  P94  1  0.821240  0.877059  0.407493  1
  P  P95  1  0.154573  0.543725  0.407493  1
  P  P96  1  0.487906  0.210392  0.407493  1
  P  P97  1  0.805937  0.218557  0.372038  1
  P  P98  1  0.803241  0.493711  0.406023  1
  P  P99  1  0.136575  0.160377  0.406023  1
  P  P100  1  0.111484  0.769336  0.416616  1
  P  P101  1  0.444817  0.436002  0.416616  1
  P  P102  1  0.446297  0.760815  0.413880  1
  P  P103  1  0.881788  0.695861  0.374650  1
  P  P104  1  0.215121  0.362527  0.374650  1
  P  P105  1  0.548454  0.029194  0.374650  1
  P  P106  1  0.778150  0.102669  0.416616  1
  P  P107  1  0.779630  0.427481  0.413880  1
  P  P108  1  0.112963  0.094148  0.413880  1
  P  P109  1  0.070519  0.571152  0.455539  1
  P  P110  1  0.403853  0.237819  0.455539  1
  P  P111  1  0.480596  0.553714  0.433988  1
  P  P112  1  0.840110  0.554703  0.400019  1
  P  P113  1  0.173444  0.221370  0.400019  1
  P  P114  1  0.506777  0.888037  0.400019  1
  P  P115  1  0.737186  0.904485  0.455539  1
  P  P116  1  0.813929  0.220380  0.433988  1
  P  P117  1  0.147262  0.887047  0.433988  1
  P  P118  1  0.176518  0.711033  0.386264  1
  P  P119  1  0.509851  0.377699  0.386264  1
  P  P120  1  0.539659  0.708250  0.390734  1
  P  P121  1  0.859121  0.675607  0.431940  1
  P  P122  1  0.192454  0.342273  0.431940  1
  P  P123  1  0.525787  0.008940  0.431940  1
  P  P124  1  0.843185  0.044366  0.386264  1
  P  P125  1  0.872992  0.374917  0.390734  1
  P  P126  1  0.206326  0.041583  0.390734  1
  P  P127  1  0.972681  0.732407  0.382111  1
  P  P128  1  0.306014  0.399074  0.382111  1
  P  P129  1  0.261998  0.690906  0.428976  1
  P  P130  1  0.651209  0.719850  0.406421  1
  P  P131  1  0.984542  0.386517  0.406421  1
  P  P132  1  0.317875  0.053183  0.406421  1
  P  P133  1  0.639347  0.065741  0.382111  1
  P  P134  1  0.595331  0.357572  0.428976  1
  P  P135  1  0.928665  0.024239  0.428976  1
  P  P136  1  0.852887  0.920923  0.449059  1
  P  P137  1  0.186220  0.587589  0.449059  1
  P  P138  1  0.258452  0.874197  0.396945  1
  P  P139  1  0.627983  0.875055  0.371712  1
  P  P140  1  0.961316  0.541721  0.371712  1
  P  P141  1  0.294649  0.208388  0.371712  1
  P  P142  1  0.519553  0.254256  0.449059  1
  P  P143  1  0.591785  0.540863  0.396945  1
  P  P144  1  0.925118  0.207530  0.396945  1
  P  P145  1  0.863732  0.608674  0.515057  1
  P  P146  1  0.197065  0.275340  0.515057  1
  P  P147  1  0.184398  0.638910  0.491250  1
  P  P148  1  0.599171  0.674559  0.442700  1
  P  P149  1  0.932505  0.341226  0.442700  1
  P  P150  1  0.265838  0.007893  0.442700  1
  P  P151  1  0.530398  0.942007  0.515057  1
  P  P152  1  0.517731  0.305577  0.491250  1
  P  P153  1  0.851065  0.972244  0.491250  1
  P  P154  1  0.898230  0.544739  0.537300  1
  P  P155  1  0.231563  0.211406  0.537300  1
  P  P156  1  0.272110  0.581343  0.498021  1
  P  P157  1  0.638578  0.562380  0.452253  1
  P  P158  1  0.971912  0.229047  0.452253  1
  P  P159  1  0.305245  0.895713  0.452253  1
  P  P160  1  0.564896  0.878073  0.537300  1
  P  P161  1  0.605443  0.248010  0.498021  1
  P  P162  1  0.938777  0.914676  0.498021  1
  P  P163  1  0.956869  0.660131  0.493579  1
  P  P164  1  0.290202  0.326797  0.493579  1
  P  P165  1  0.291477  0.622310  0.448046  1
  P  P166  1  0.580426  0.624810  0.487559  1
  P  P167  1  0.913759  0.291477  0.487559  1
  P  P168  1  0.247092  0.958143  0.487559  1
  P  P169  1  0.623535  -0.006536  0.493579  1
  P  P170  1  0.624810  0.288977  0.448046  1
  P  P171  1  0.958144  0.955644  0.448046  1
  P  P172  1  0.973652  0.582832  0.493795  1
  P  P173  1  0.306985  0.249499  0.493795  1
  P  P174  1  0.261408  0.527501  0.537665  1
  P  P175  1  0.590679  0.555635  0.510111  1
  P  P176  1  0.924012  0.222301  0.510111  1
  P  P177  1  0.257346  0.888968  0.510111  1
  P  P178  1  0.640318  0.916166  0.493795  1
  P  P179  1  0.594741  0.194167  0.537665  1
  P  P180  1  0.928074  0.860834  0.537665  1
  P  P181  1  0.176861  0.650759  0.422388  1
  P  P182  1  0.510194  0.317426  0.422388  1
  P  P183  1  0.467201  0.666006  0.496397  1
  P  P184  1  0.811312  0.664565  0.486203  1
  P  P185  1  0.144646  0.331232  0.486203  1
  P  P186  1  0.477979  -0.002101  0.486203  1
  P  P187  1  0.843527  0.984093  0.422388  1
  P  P188  1  0.800534  0.332672  0.496397  1
  P  P189  1  0.133868  -0.000661  0.496397  1
  P  P190  1  0.163107  0.557482  0.501183  1
  P  P191  1  0.496440  0.224149  0.501183  1
  P  P192  1  0.577333  0.508343  0.452587  1
  P  P193  1  0.798664  0.520681  0.512127  1
  P  P194  1  0.131997  0.187347  0.512127  1
  P  P195  1  0.465331  0.854014  0.512127  1
  P  P196  1  0.829773  0.890816  0.501183  1
  P  P197  1  0.910667  0.175010  0.452587  1
  P  P198  1  0.244000  0.841676  0.452587  1
  P  P199  1  0.925278  0.851965  0.471339  1
  P  P200  1  0.258611  0.518631  0.471339  1
  P  P201  1  0.356686  0.825679  0.427941  1
  P  P202  1  0.576751  0.805649  0.482701  1
  P  P203  1  0.910085  0.472316  0.482701  1
  P  P204  1  0.243418  0.138983  0.482701  1
  P  P205  1  0.591945  0.185298  0.471339  1
  P  P206  1  0.690019  0.492346  0.427941  1
  P  P207  1  0.023352  0.159013  0.427941  1
  P  P208  1  0.864049  0.690303  0.534468  1
  P  P209  1  0.197382  0.356970  0.534468  1
  P  P210  1  0.257990  0.687574  0.491222  1
  P  P211  1  0.657782  0.727128  0.469463  1
  P  P212  1  0.991116  0.393795  0.469463  1
  P  P213  1  0.324449  0.060462  0.469463  1
  P  P214  1  0.530716  0.023636  0.534468  1
  P  P215  1  0.591323  0.354241  0.491222  1
  P  P216  1  0.924656  0.020907  0.491222  1
  P  P217  1  0.080529  0.768246  0.477210  1
  P  P218  1  0.413862  0.434913  0.477210  1
  P  P219  1  0.459909  0.802277  0.465649  1
  P  P220  1  0.706661  0.784907  0.481850  1
  P  P221  1  0.039994  0.451573  0.481850  1
  P  P222  1  0.373328  0.118240  0.481850  1
  P  P223  1  0.747195  0.101579  0.477210  1
  P  P224  1  0.793242  0.468944  0.465649  1
  P  P225  1  0.126575  0.135610  0.465649  1
  P  P226  1  0.150245  0.706596  0.460508  1
  P  P227  1  0.483579  0.373263  0.460508  1
  P  P228  1  0.432755  0.735847  0.478964  1
  P  P229  1  0.737144  0.712814  0.517756  1
  P  P230  1  0.070477  0.379481  0.517756  1
  P  P231  1  0.403811  0.046147  0.517756  1
  P  P232  1  0.816912  0.039929  0.460508  1
  P  P233  1  0.766088  0.402513  0.478964  1
  P  P234  1  0.099422  0.069180  0.478964  1
  P  P235  1  0.130281  0.821896  0.457932  1
  P  P236  1  0.463614  0.488563  0.457932  1
  P  P237  1  0.350344  0.838469  0.490598  1
  P  P238  1  0.665989  0.851161  0.469995  1
  P  P239  1  0.999323  0.517827  0.469995  1
  P  P240  1  0.332656  0.184494  0.469995  1
  P  P241  1  0.796947  0.155229  0.457932  1
  P  P242  1  0.683678  0.505135  0.490598  1
  P  P243  1  0.017011  0.171802  0.490598  1
  P  P244  1  0.031153  0.710412  0.488375  1
  P  P245  1  0.364486  0.377078  0.488375  1
  P  P246  1  0.366074  0.676085  0.464262  1
  P  P247  1  0.784087  0.729771  0.461556  1
  P  P248  1  0.117420  0.396438  0.461556  1
  P  P249  1  0.450754  0.063105  0.461556  1
  P  P250  1  0.697819  0.043745  0.488375  1
  P  P251  1  0.699407  0.342752  0.464262  1
  P  P252  1  0.032740  0.009419  0.464262  1
  P  P253  1  0.983373  0.491959  0.527650  1
  P  P254  1  0.316707  0.158625  0.527650  1
  P  P255  1  0.365373  0.502502  0.505648  1
  P  P256  1  0.763888  0.538894  0.453989  1
  P  P257  1  0.097221  0.205561  0.453989  1
  P  P258  1  0.430554  0.872228  0.453989  1
  P  P259  1  0.650040  0.825292  0.527650  1
  P  P260  1  0.698706  0.169168  0.505648  1
  P  P261  1  0.032040  0.835835  0.505648  1
  P  P262  1  0.077397  0.648782  0.457973  1
  P  P263  1  0.410730  0.315449  0.457973  1
  P  P264  1  0.469465  0.689068  0.434775  1
  P  P265  1  0.678208  0.660207  0.492426  1
  P  P266  1  1.011541  0.326874  0.492426  1
  P  P267  1  0.344874  -0.006460  0.492426  1
  P  P268  1  0.744063  0.982116  0.457973  1
  P  P269  1  0.802799  0.355735  0.434775  1
  P  P270  1  0.136132  0.022401  0.434775  1
  P  P271  1  0.901392  0.726786  0.481608  1
  P  P272  1  0.234725  0.393453  0.481608  1
  P  P273  1  0.147651  0.698735  0.525331  1
  P  P274  1  0.563747  0.700724  0.500186  1
  P  P275  1  0.897080  0.367391  0.500186  1
  P  P276  1  0.230414  0.034058  0.500186  1
  P  P277  1  0.568058  0.060119  0.481608  1
  P  P278  1  0.480984  0.365402  0.525331  1
  P  P279  1  0.814317  0.032069  0.525331  1
  P  P280  1  0.751646  0.846076  0.514426  1
  P  P281  1  0.084979  0.512743  0.514426  1
  P  P282  1  0.137224  0.870985  0.498007  1
  P  P283  1  0.545084  0.877876  0.473383  1
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  P  P574  1  0.231402  0.081467  0.691204  1
  P  P575  1  0.275855  0.425300  0.619297  1
  P  P576  1  0.609188  0.091967  0.619297  1
