# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   51.45254751
_cell_length_b   17.45750306
_cell_length_c   52.91373061
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   78.42627695
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P216
_cell_volume   46562.4723362
_cell_formula_units_Z   216
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  0.619677  0.665369  0.374014  1
  P  P2  1  0.938092  0.621115  0.326395  1
  P  P3  1  0.301263  0.709623  0.421633  1
  P  P4  1  0.608713  0.003629  0.342427  1
  P  P5  1  0.926920  0.965554  0.294639  1
  P  P6  1  0.290299  0.047883  0.390046  1
  P  P7  1  0.619484  0.586050  0.427241  1
  P  P8  1  0.937899  0.541796  0.379622  1
  P  P9  1  0.258051  0.496622  0.330899  1
  P  P10  1  0.608906  0.082949  0.289199  1
  P  P11  1  0.972078  0.171457  0.384437  1
  P  P12  1  0.290492  0.127203  0.336818  1
  P  P13  1  0.671751  0.559189  0.395005  1
  P  P14  1  0.990165  0.514935  0.347386  1
  P  P15  1  0.306723  0.471610  0.300795  1
  P  P16  1  0.556640  0.109810  0.321436  1
  P  P17  1  0.919812  0.198318  0.416674  1
  P  P18  1  0.238226  0.154064  0.369055  1
  P  P19  1  0.624063  0.483807  0.378022  1
  P  P20  1  0.942477  0.439553  0.330403  1
  P  P21  1  0.305649  0.528061  0.425641  1
  P  P22  1  0.604328  0.185192  0.338419  1
  P  P23  1  0.922833  0.134768  0.290892  1
  P  P24  1  0.285914  0.229446  0.386038  1
  P  P25  1  0.745051  0.798947  0.381849  1
  P  P26  1  0.063465  0.754693  0.334230  1
  P  P27  1  0.426637  0.843201  0.429468  1
  P  P28  1  0.483761  0.868794  0.334015  1
  P  P29  1  0.801827  0.825658  0.286902  1
  P  P30  1  0.164926  0.914305  0.382211  1
  P  P31  1  0.692207  0.850724  0.412509  1
  P  P32  1  0.010621  0.806470  0.364890  1
  P  P33  1  0.329840  0.761782  0.317524  1
  P  P34  1  0.535365  0.818345  0.304032  1
  P  P35  1  0.899356  0.906783  0.399170  1
  P  P36  1  0.217770  0.862529  0.351551  1
  P  P37  1  0.696145  0.606866  0.294475  1
  P  P38  1  0.059370  0.694926  0.389762  1
  P  P39  1  0.377434  0.652868  0.341878  1
  P  P40  1  0.532193  0.062581  0.421917  1
  P  P41  1  0.850607  0.018327  0.374298  1
  P  P42  1  0.169021  0.974073  0.326679  1
  P  P43  1  0.742839  0.915254  0.427413  1
  P  P44  1  0.061253  0.871000  0.379794  1
  P  P45  1  0.379285  0.824845  0.332115  1
  P  P46  1  0.485896  0.755380  0.289455  1
  P  P47  1  0.848723  0.842253  0.384266  1
  P  P48  1  0.167138  0.797999  0.336647  1
  P  P49  1  0.521151  0.404240  0.396934  1
  P  P50  1  0.839565  0.359986  0.349315  1
  P  P51  1  0.157527  0.317832  0.302017  1
  P  P52  1  0.707707  0.262479  0.319558  1
  P  P53  1  0.070411  0.353267  0.414745  1
  P  P54  1  0.388825  0.309013  0.367125  1
  P  P55  1  0.469791  0.406903  0.293918  1
  P  P56  1  0.833016  0.495565  0.389226  1
  P  P57  1  0.151107  0.450117  0.341061  1
  P  P58  1  0.758547  0.261941  0.422453  1
  P  P59  1  0.076961  0.217687  0.374834  1
  P  P60  1  0.395375  0.173433  0.327215  1
  P  P61  1  0.465921  0.517241  0.403948  1
  P  P62  1  0.784335  0.472987  0.356329  1
  P  P63  1  0.103570  0.428183  0.308881  1
  P  P64  1  0.761654  0.152083  0.312693  1
  P  P65  1  0.125642  0.240266  0.407731  1
  P  P66  1  0.444056  0.196012  0.360112  1
  P  P67  1  0.513122  0.578705  0.378873  1
  P  P68  1  0.831536  0.534451  0.331254  1
  P  P69  1  0.194707  0.622958  0.426492  1
  P  P70  1  0.715565  0.092094  0.337244  1
  P  P71  1  0.033729  0.046396  0.289894  1
  P  P72  1  0.396855  0.134548  0.385186  1
  P  P73  1  0.664435  0.798131  0.516871  1
  P  P74  1  0.982849  0.753877  0.469252  1
  P  P75  1  0.346021  0.842385  0.564490  1
  P  P76  1  0.653471  0.136391  0.485284  1
  P  P77  1  0.971885  0.092137  0.437665  1
  P  P78  1  0.335057  0.180645  0.532903  1
  P  P79  1  0.664242  0.718812  0.570099  1
  P  P80  1  0.982656  0.674558  0.522479  1
  P  P81  1  0.301070  0.630304  0.474860  1
  P  P82  1  0.653664  0.215711  0.432056  1
  P  P83  1  0.016836  0.304218  0.527295  1
  P  P84  1  0.335250  0.259964  0.479675  1
  P  P85  1  0.716508  0.691951  0.537862  1
  P  P86  1  0.034923  0.647697  0.490243  1
  P  P87  1  0.353337  0.603443  0.442624  1
  P  P88  1  0.601398  0.242572  0.464293  1
  P  P89  1  0.964570  0.331080  0.559531  1
  P  P90  1  0.282984  0.286826  0.511912  1
  P  P91  1  0.668820  0.616569  0.520879  1
  P  P92  1  0.987235  0.572315  0.473260  1
  P  P93  1  0.350406  0.660823  0.568498  1
  P  P94  1  0.649086  0.317954  0.481276  1
  P  P95  1  0.967500  0.273700  0.433657  1
  P  P96  1  0.330672  0.362208  0.528895  1
  P  P97  1  0.789809  0.931709  0.524706  1
  P  P98  1  0.108223  0.887455  0.477087  1
  P  P99  1  0.471395  0.975963  0.572325  1
  P  P100  1  0.528098  0.002813  0.477449  1
  P  P101  1  0.846512  0.958559  0.429830  1
  P  P102  1  0.209684  0.047067  0.525068  1
  P  P103  1  0.736965  0.983486  0.555366  1
  P  P104  1  0.055379  0.939232  0.507747  1
  P  P105  1  0.373793  0.894978  0.460128  1
  P  P106  1  0.580942  0.951037  0.446789  1
  P  P107  1  0.944113  0.039545  0.542027  1
  P  P108  1  0.262528  0.995291  0.494408  1
  P  P109  1  0.740956  0.739180  0.437381  1
  P  P110  1  0.104128  0.827688  0.532619  1
  P  P111  1  0.422542  0.783434  0.485000  1
  P  P112  1  0.576950  0.195343  0.564774  1
  P  P113  1  0.895365  0.151089  0.517155  1
  P  P114  1  0.213779  0.106835  0.469536  1
  P  P115  1  0.787597  0.048016  0.570270  1
  P  P116  1  0.106011  0.003762  0.522651  1
  P  P117  1  0.424425  0.959508  0.475032  1
  P  P118  1  0.530309  0.886507  0.431885  1
  P  P119  1  0.893481  0.975015  0.527123  1
  P  P120  1  0.211895  0.930761  0.479504  1
  P  P121  1  0.565909  0.537002  0.539791  1
  P  P122  1  0.884323  0.492748  0.492172  1
  P  P123  1  0.202737  0.448494  0.444553  1
  P  P124  1  0.751997  0.397521  0.462364  1
  P  P125  1  0.115169  0.486029  0.557602  1
  P  P126  1  0.433583  0.441775  0.509983  1
  P  P127  1  0.514602  0.539819  0.436845  1
  P  P128  1  0.877774  0.628327  0.532083  1
  P  P129  1  0.196188  0.584073  0.484464  1
  P  P130  1  0.803305  0.394703  0.565310  1
  P  P131  1  0.121719  0.350449  0.517691  1
  P  P132  1  0.440133  0.306195  0.470072  1
  P  P133  1  0.510678  0.650003  0.546805  1
  P  P134  1  0.829093  0.605749  0.499186  1
  P  P135  1  0.147507  0.561495  0.451567  1
  P  P136  1  0.807228  0.284520  0.455350  1
  P  P137  1  0.170400  0.373028  0.550588  1
  P  P138  1  0.488814  0.328774  0.502969  1
  P  P139  1  0.557879  0.711466  0.521730  1
  P  P140  1  0.876293  0.667212  0.474111  1
  P  P141  1  0.239465  0.755720  0.569350  1
  P  P142  1  0.760027  0.223056  0.480425  1
  P  P143  1  0.078441  0.178802  0.432805  1
  P  P144  1  0.441613  0.267310  0.528044  1
  P  P145  1  0.709193  0.930893  0.659728  1
  P  P146  1  0.027607  0.886639  0.612109  1
  P  P147  1  0.390987  0.968969  0.707516  1
  P  P148  1  0.698229  0.269153  0.628141  1
  P  P149  1  0.016643  0.224899  0.580522  1
  P  P150  1  0.379815  0.313407  0.675760  1
  P  P151  1  0.709000  0.851574  0.712956  1
  P  P152  1  0.027414  0.807320  0.665337  1
  P  P153  1  0.345828  0.763066  0.617718  1
  P  P154  1  0.698422  0.348472  0.574914  1
  P  P155  1  0.059855  0.437901  0.671256  1
  P  P156  1  0.380008  0.392726  0.622533  1
  P  P157  1  0.761266  0.824713  0.680719  1
  P  P158  1  0.079680  0.780459  0.633100  1
  P  P159  1  0.398094  0.736205  0.585481  1
  P  P160  1  0.646156  0.375334  0.607150  1
  P  P161  1  0.011183  0.462913  0.701360  1
  P  P162  1  0.327742  0.419588  0.654769  1
  P  P163  1  0.713578  0.749331  0.663736  1
  P  P164  1  0.031992  0.705077  0.616117  1
  P  P165  1  0.395073  0.799755  0.711263  1
  P  P166  1  0.693844  0.450716  0.624133  1
  P  P167  1  0.012258  0.406462  0.576514  1
  P  P168  1  0.375430  0.494970  0.671752  1
  P  P169  1  0.834146  0.065729  0.668139  1
  P  P170  1  0.152980  0.020217  0.619944  1
  P  P171  1  0.516079  0.108864  0.715253  1
  P  P172  1  0.572856  0.135575  0.620306  1
  P  P173  1  0.891270  0.091321  0.572687  1
  P  P174  1  0.254441  0.179829  0.667925  1
  P  P175  1  0.782541  0.116178  0.698123  1
  P  P176  1  0.100137  0.071994  0.650604  1
  P  P177  1  0.418551  0.027740  0.602985  1
  P  P178  1  0.625699  0.083799  0.589646  1
  P  P179  1  0.988066  0.172740  0.684631  1
  P  P180  1  0.307285  0.128053  0.637265  1
  P  P181  1  0.785714  0.871942  0.580238  1
  P  P182  1  0.148885  0.960450  0.675476  1
  P  P183  1  0.467300  0.916196  0.627857  1
  P  P184  1  0.621762  0.327657  0.707680  1
  P  P185  1  0.940472  0.281654  0.660277  1
  P  P186  1  0.258536  0.239597  0.612393  1
  P  P187  1  0.832010  0.179142  0.712700  1
  P  P188  1  0.150769  0.136524  0.665508  1
  P  P189  1  0.469183  0.092270  0.617889  1
  P  P190  1  0.575067  0.019268  0.574742  1
  P  P191  1  0.938621  0.109678  0.670040  1
  P  P192  1  0.256653  0.063522  0.622361  1
  P  P193  1  0.610200  0.672043  0.682597  1
  P  P194  1  0.929081  0.625510  0.635030  1
  P  P195  1  0.247495  0.581256  0.587410  1
  P  P196  1  0.796755  0.530282  0.605221  1
  P  P197  1  0.160380  0.616690  0.700138  1
  P  P198  1  0.478341  0.574536  0.652840  1
  P  P199  1  0.559360  0.672581  0.579702  1
  P  P200  1  0.922531  0.761089  0.674940  1
  P  P201  1  0.240946  0.716835  0.627321  1
  P  P202  1  0.848116  0.527620  0.708237  1
  P  P203  1  0.166799  0.484405  0.661094  1
  P  P204  1  0.484890  0.438957  0.612929  1
  P  P205  1  0.556252  0.782440  0.689462  1
  P  P206  1  0.873850  0.738511  0.642043  1
  P  P207  1  0.192264  0.694257  0.594424  1
  P  P208  1  0.851986  0.417282  0.598207  1
  P  P209  1  0.214336  0.506340  0.693274  1
  P  P210  1  0.533572  0.461536  0.645826  1
  P  P211  1  0.602341  0.842428  0.664911  1
  P  P212  1  0.921051  0.799974  0.616969  1
  P  P213  1  0.284177  0.888127  0.712261  1
  P  P214  1  0.804785  0.355818  0.623282  1
  P  P215  1  0.123199  0.311564  0.575663  1
  P  P216  1  0.486371  0.400072  0.670901  1
