# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   14.12031704
_cell_length_b   31.60766111
_cell_length_c   49.36786011
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   96.99519544
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P256
_cell_volume   21869.3709259
_cell_formula_units_Z   256
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  0.210553  0.509722  0.366945  1
  P  P2  1  0.793964  0.478171  0.406125  1
  P  P3  1  0.710553  0.009722  0.366945  1
  P  P4  1  0.293964  -0.021829  0.406125  1
  P  P5  1  0.347804  0.439007  0.388602  1
  P  P6  1  0.945619  0.404916  0.425891  1
  P  P7  1  0.847804  0.939007  0.388602  1
  P  P8  1  0.445619  0.904916  0.425891  1
  P  P9  1  1.051486  0.498448  0.414683  1
  P  P10  1  0.437266  0.542218  0.375691  1
  P  P11  1  0.551486  -0.001552  0.414683  1
  P  P12  1  0.937266  0.042218  0.375691  1
  P  P13  1  0.732421  0.389943  0.450981  1
  P  P14  1  0.186794  0.421081  0.434742  1
  P  P15  1  0.232421  0.889943  0.450981  1
  P  P16  1  0.686794  0.921081  0.434742  1
  P  P17  1  0.533924  0.542609  0.433280  1
  P  P18  1  0.922064  0.569769  0.392788  1
  P  P19  1  1.033924  0.042609  0.433280  1
  P  P20  1  0.422064  0.069769  0.392788  1
  P  P21  1  0.349772  0.349206  0.438103  1
  P  P22  1  0.763223  0.376233  0.386969  1
  P  P23  1  0.849772  0.849206  0.438103  1
  P  P24  1  0.263223  0.876233  0.386969  1
  P  P25  1  0.339782  0.802646  0.425348  1
  P  P26  1  0.707935  0.825997  0.390846  1
  P  P27  1  0.839782  0.302646  0.425348  1
  P  P28  1  0.207935  0.325997  0.390846  1
  P  P29  1  0.393149  0.618713  0.423906  1
  P  P30  1  1.010449  0.583457  0.453446  1
  P  P31  1  0.893149  0.118713  0.423906  1
  P  P32  1  0.510449  0.083457  0.453446  1
  P  P33  1  0.493928  0.725511  0.422644  1
  P  P34  1  0.878247  0.762694  0.397364  1
  P  P35  1  0.993928  0.225511  0.422644  1
  P  P36  1  0.378247  0.262694  0.397364  1
  P  P37  1  0.470097  0.655887  0.481403  1
  P  P38  1  0.827183  0.657466  0.406302  1
  P  P39  1  0.970097  0.155887  0.481403  1
  P  P40  1  0.327183  0.157466  0.406302  1
  P  P41  1  0.932863  0.855182  0.372892  1
  P  P42  1  0.669522  0.718150  0.383329  1
  P  P43  1  0.432863  0.355182  0.372892  1
  P  P44  1  0.169522  0.218150  0.383329  1
  P  P45  1  0.623517  0.644191  0.432803  1
  P  P46  1  0.230917  0.616965  0.474649  1
  P  P47  1  0.123517  0.144191  0.432803  1
  P  P48  1  0.730917  0.116965  0.474649  1
  P  P49  1  0.575021  0.425945  0.406054  1
  P  P50  1  0.070818  0.326501  0.443572  1
  P  P51  1  0.075021  0.925945  0.406054  1
  P  P52  1  0.570818  0.826501  0.443572  1
  P  P53  1  0.296379  0.518766  0.425417  1
  P  P54  1  0.684312  0.567991  0.385618  1
  P  P55  1  0.796379  0.018766  0.425417  1
  P  P56  1  0.184312  0.067991  0.385618  1
  P  P57  1  0.170499  0.592689  0.407801  1
  P  P58  1  0.774900  0.567869  0.443462  1
  P  P59  1  0.670499  0.092689  0.407801  1
  P  P60  1  0.274900  0.067869  0.443462  1
  P  P61  1  0.487991  0.836245  0.381134  1
  P  P62  1  0.074347  0.824696  0.417917  1
  P  P63  1  0.987991  0.336245  0.381134  1
  P  P64  1  0.574347  0.324696  0.417917  1
  P  P65  1  0.423299  0.448110  0.450260  1
  P  P66  1  1.043626  0.428642  0.485480  1
  P  P67  1  0.923299  0.948110  0.450260  1
  P  P68  1  0.543626  0.928642  0.485480  1
  P  P69  1  0.530214  0.361909  0.478903  1
  P  P70  1  0.119986  0.345179  0.506768  1
  P  P71  1  1.030214  0.861909  0.478903  1
  P  P72  1  0.619986  0.845179  0.506768  1
  P  P73  1  0.275925  0.443619  0.497850  1
  P  P74  1  0.653402  0.475981  0.459971  1
  P  P75  1  0.775925  0.943619  0.497850  1
  P  P76  1  0.153402  -0.024019  0.459971  1
  P  P77  1  0.919871  0.304416  0.538823  1
  P  P78  1  0.333445  0.312012  0.505211  1
  P  P79  1  0.419871  0.804416  0.538823  1
  P  P80  1  0.833445  0.812012  0.505211  1
  P  P81  1  0.757858  0.506745  0.513130  1
  P  P82  1  0.152784  0.517078  0.473104  1
  P  P83  1  0.257858  0.006745  0.513130  1
  P  P84  1  0.652784  0.017078  0.473104  1
  P  P85  1  0.531569  0.256963  0.518948  1
  P  P86  1  0.888514  0.350893  0.483218  1
  P  P87  1  1.031569  0.756963  0.518948  1
  P  P88  1  0.388514  0.850893  0.483218  1
  P  P89  1  0.435864  0.756802  0.480667  1
  P  P90  1  0.938489  0.762158  0.459636  1
  P  P91  1  0.935864  0.256802  0.480667  1
  P  P92  1  0.438489  0.262158  0.459636  1
  P  P93  1  0.624922  0.582373  0.491104  1
  P  P94  1  0.235393  0.554573  0.531031  1
  P  P95  1  0.124922  0.082373  0.491104  1
  P  P96  1  0.735393  0.054573  0.531031  1
  P  P97  1  0.649940  0.676188  0.551439  1
  P  P98  1  1.054475  0.682531  0.472303  1
  P  P99  1  0.149940  0.176188  0.551439  1
  P  P100  1  0.554475  0.182531  0.472303  1
  P  P101  1  0.719535  0.589409  0.551843  1
  P  P102  1  0.082300  0.626244  0.524395  1
  P  P103  1  0.219535  0.089409  0.551843  1
  P  P104  1  0.582300  0.126244  0.524395  1
  P  P105  1  0.275975  0.701521  0.443608  1
  P  P106  1  0.837257  0.693316  0.505425  1
  P  P107  1  0.775975  0.201521  0.443608  1
  P  P108  1  0.337257  0.193316  0.505425  1
  P  P109  1  0.871110  0.596451  0.501570  1
  P  P110  1  0.479724  0.586461  0.541909  1
  P  P111  1  0.371110  0.096451  0.501570  1
  P  P112  1  0.979724  0.086461  0.541909  1
  P  P113  1  0.676307  0.283677  0.468434  1
  P  P114  1  0.142058  0.243359  0.505053  1
  P  P115  1  0.176307  0.783677  0.468434  1
  P  P116  1  0.642058  0.743359  0.505053  1
  P  P117  1  0.506721  0.486259  0.507099  1
  P  P118  1  0.893562  0.487906  0.463774  1
  P  P119  1  1.006721  -0.013741  0.507099  1
  P  P120  1  0.393562  -0.012094  0.463774  1
  P  P121  1  0.387033  0.552062  0.482375  1
  P  P122  1  1.000000  0.521144  0.520041  1
  P  P123  1  0.887033  0.052062  0.482375  1
  P  P124  1  0.500000  0.021144  0.520041  1
  P  P125  1  0.713750  0.751766  0.444155  1
  P  P126  1  0.237180  0.715726  0.512093  1
  P  P127  1  0.213750  0.251766  0.444155  1
  P  P128  1  0.737180  0.215726  0.512093  1
  P  P129  1  0.643028  0.418418  0.524725  1
  P  P130  1  0.280264  0.381582  0.552172  1
  P  P131  1  0.143028  0.918418  0.524725  1
  P  P132  1  0.780264  0.881582  0.552172  1
  P  P133  1  0.712623  0.331638  0.525128  1
  P  P134  1  0.308088  0.325295  0.604265  1
  P  P135  1  0.212623  0.831638  0.525128  1
  P  P136  1  0.808088  0.825295  0.604265  1
  P  P137  1  0.491453  0.411375  0.574997  1
  P  P138  1  0.882839  0.421365  0.534658  1
  P  P139  1  0.991453  0.911375  0.574997  1
  P  P140  1  0.382839  0.921365  0.534658  1
  P  P141  1  0.086589  0.306305  0.632960  1
  P  P142  1  0.525307  0.314510  0.571142  1
  P  P143  1  0.586589  0.806305  0.632960  1
  P  P144  1  1.025307  0.814510  0.571142  1
  P  P145  1  0.975530  0.455764  0.594193  1
  P  P146  1  0.362564  0.486682  0.556527  1
  P  P147  1  0.475530  0.955764  0.594193  1
  P  P148  1  0.862564  -0.013318  0.556527  1
  P  P149  1  0.648814  0.256060  0.632412  1
  P  P150  1  0.125384  0.292100  0.564475  1
  P  P151  1  0.148814  0.756060  0.632412  1
  P  P152  1  0.625384  0.792100  0.564475  1
  P  P153  1  0.686257  0.724149  0.608133  1
  P  P154  1  0.220505  0.764467  0.571514  1
  P  P155  1  0.186257  0.224149  0.608133  1
  P  P156  1  0.720505  0.264467  0.571514  1
  P  P157  1  0.855842  0.521567  0.569468  1
  P  P158  1  0.469002  0.519920  0.612793  1
  P  P159  1  0.355842  0.021567  0.569468  1
  P  P160  1  0.969002  0.019920  0.612793  1
  P  P161  1  0.832350  0.645917  0.597665  1
  P  P162  1  0.242578  0.662647  0.569800  1
  P  P163  1  0.332350  0.145917  0.597665  1
  P  P164  1  0.742578  0.162647  0.569800  1
  P  P165  1  0.939265  0.559716  0.626308  1
  P  P166  1  0.318937  0.579184  0.591088  1
  P  P167  1  0.439265  0.059716  0.626308  1
  P  P168  1  0.818937  0.079184  0.591088  1
  P  P169  1  0.442692  0.703410  0.537744  1
  P  P170  1  1.029118  0.695814  0.571356  1
  P  P171  1  0.942692  0.203410  0.537744  1
  P  P172  1  0.529118  0.195814  0.571356  1
  P  P173  1  0.086639  0.564208  0.578718  1
  P  P174  1  0.709161  0.531845  0.616596  1
  P  P175  1  0.586639  0.064208  0.578718  1
  P  P176  1  0.209161  0.031845  0.616596  1
  P  P177  1  0.926699  0.251024  0.595901  1
  P  P178  1  0.424075  0.245668  0.616931  1
  P  P179  1  0.426699  0.751024  0.595901  1
  P  P180  1  0.924075  0.745668  0.616931  1
  P  P181  1  0.737642  0.425453  0.585463  1
  P  P182  1  0.127170  0.453253  0.545536  1
  P  P183  1  0.237642  0.925453  0.585463  1
  P  P184  1  0.627170  0.953253  0.545536  1
  P  P185  1  0.604705  0.501082  0.563437  1
  P  P186  1  0.209779  0.490748  0.603463  1
  P  P187  1  0.104705  0.001082  0.563437  1
  P  P188  1  0.709779  -0.009252  0.603463  1
  P  P189  1  0.830994  0.750863  0.557619  1
  P  P190  1  0.474049  0.656933  0.593349  1
  P  P191  1  0.330994  0.250863  0.557619  1
  P  P192  1  0.974049  0.156933  0.593349  1
  P  P193  1  0.892466  0.351940  0.595164  1
  P  P194  1  0.535380  0.350360  0.670265  1
  P  P195  1  0.392466  0.851940  0.595164  1
  P  P196  1  1.035380  0.850360  0.670265  1
  P  P197  1  0.868635  0.282315  0.653924  1
  P  P198  1  0.484317  0.245133  0.679203  1
  P  P199  1  0.368635  0.782315  0.653924  1
  P  P200  1  0.984317  0.745133  0.679203  1
  P  P201  1  0.739047  0.363635  0.643764  1
  P  P202  1  0.131647  0.390861  0.601918  1
  P  P203  1  0.239047  0.863635  0.643764  1
  P  P204  1  0.631647  0.890861  0.601918  1
  P  P205  1  0.429701  0.152644  0.703675  1
  P  P206  1  0.693041  0.289676  0.693238  1
  P  P207  1  0.929701  0.652644  0.703675  1
  P  P208  1  0.193041  0.789676  0.693238  1
  P  P209  1  0.192064  0.415138  0.668767  1
  P  P210  1  0.587664  0.439957  0.633105  1
  P  P211  1  0.692064  0.915138  0.668767  1
  P  P212  1  0.087664  0.939957  0.633105  1
  P  P213  1  0.874573  0.171581  0.695433  1
  P  P214  1  0.288216  0.183130  0.658651  1
  P  P215  1  0.374573  0.671581  0.695433  1
  P  P216  1  0.788216  0.683130  0.658651  1
  P  P217  1  0.787543  0.581882  0.670514  1
  P  P218  1  0.291745  0.681325  0.632995  1
  P  P219  1  0.287543  0.081882  0.670514  1
  P  P220  1  0.791745  0.181325  0.632995  1
  P  P221  1  1.066184  0.489060  0.651150  1
  P  P222  1  0.678251  0.439835  0.690949  1
  P  P223  1  0.566184  -0.010940  0.651150  1
  P  P224  1  0.178251  0.939835  0.690949  1
  P  P225  1  1.014760  0.568819  0.687965  1
  P  P226  1  0.416945  0.602910  0.650677  1
  P  P227  1  0.514760  0.068819  0.687965  1
  P  P228  1  0.916945  0.102910  0.650677  1
  P  P229  1  0.152010  0.498104  0.709623  1
  P  P230  1  0.568599  0.529655  0.670443  1
  P  P231  1  0.652010  -0.001896  0.709623  1
  P  P232  1  1.068599  0.029655  0.670443  1
  P  P233  1  0.630142  0.617883  0.625586  1
  P  P234  1  0.175769  0.586745  0.641825  1
  P  P235  1  0.130142  0.117883  0.625586  1
  P  P236  1  0.675769  0.086745  0.641825  1
  P  P237  1  0.311077  0.509378  0.661885  1
  P  P238  1  0.925297  0.465608  0.700876  1
  P  P239  1  0.811077  0.009378  0.661885  1
  P  P240  1  0.425297  0.965608  0.700876  1
  P  P241  1  1.022781  0.205180  0.651219  1
  P  P242  1  0.654628  0.181829  0.685721  1
  P  P243  1  0.522781  0.705180  0.651219  1
  P  P244  1  0.154628  0.681829  0.685721  1
  P  P245  1  0.969414  0.389113  0.652662  1
  P  P246  1  0.352114  0.424369  0.623121  1
  P  P247  1  0.469414  0.889113  0.652662  1
  P  P248  1  0.852114  0.924369  0.623121  1
  P  P249  1  0.828640  0.465217  0.643288  1
  P  P250  1  0.440499  0.438057  0.683779  1
  P  P251  1  0.328640  0.965217  0.643288  1
  P  P252  1  0.940499  0.938057  0.683779  1
  P  P253  1  1.012791  0.658620  0.638464  1
  P  P254  1  0.599341  0.631594  0.689598  1
  P  P255  1  0.512791  0.158620  0.638464  1
  P  P256  1  0.099341  0.131594  0.689598  1
