# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   16.46101366
_cell_length_b   49.44353115
_cell_length_c   57.73050109
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   95.87966503
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P216
_cell_volume   46739.1306995
_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  0.293263  0.228897  0.335407  1
  P  P2  1  0.323379  0.564508  0.288202  1
  P  P3  1  0.263292  0.895411  0.383026  1
  P  P4  1  0.291998  0.106322  0.332121  1
  P  P5  1  0.232057  0.439349  0.427359  1
  P  P6  1  0.262027  0.772835  0.379740  1
  P  P7  1  0.266898  0.271950  0.296882  1
  P  P8  1  0.206956  0.604978  0.392120  1
  P  P9  1  0.236927  0.938464  0.344501  1
  P  P10  1  0.318363  0.063269  0.370646  1
  P  P11  1  0.342541  0.396818  0.322254  1
  P  P12  1  0.288392  0.729782  0.418265  1
  P  P13  1  0.439304  0.270815  0.319897  1
  P  P14  1  0.379363  0.603842  0.415136  1
  P  P15  1  0.409334  0.937328  0.367517  1
  P  P16  1  0.145957  0.064404  0.347630  1
  P  P17  1  0.181934  0.397874  0.300756  1
  P  P18  1  0.115986  0.730918  0.395249  1
  P  P19  1  0.294345  0.290550  0.348531  1
  P  P20  1  0.324384  0.621958  0.300469  1
  P  P21  1  0.264375  0.957063  0.396150  1
  P  P22  1  0.290916  0.044669  0.318997  1
  P  P23  1  0.230974  0.377697  0.414235  1
  P  P24  1  0.260945  0.711183  0.366616  1
  P  P25  1  0.685266  0.186871  0.297912  1
  P  P26  1  0.625530  0.519892  0.393175  1
  P  P27  1  0.655501  0.853379  0.345556  1
  P  P28  1  0.899789  0.148354  0.369591  1
  P  P29  1  0.929760  0.481840  0.321972  1
  P  P30  1  0.869819  0.814868  0.417210  1
  P  P31  1  0.423484  0.178760  0.416863  1
  P  P32  1  0.453455  0.512246  0.369244  1
  P  P33  1  0.483426  0.845732  0.321625  1
  P  P34  1  0.071864  0.156000  0.393522  1
  P  P35  1  0.101835  0.489487  0.345903  1
  P  P36  1  0.129455  0.822759  0.298587  1
  P  P37  1  0.557413  0.223675  0.398975  1
  P  P38  1  0.587384  0.557162  0.351356  1
  P  P39  1  0.617355  0.890648  0.303737  1
  P  P40  1  0.937935  0.111085  0.411410  1
  P  P41  1  0.967906  0.444571  0.363791  1
  P  P42  1  0.998697  0.778882  0.316095  1
  P  P43  1  0.577700  0.161985  0.390639  1
  P  P44  1  0.607671  0.495471  0.343020  1
  P  P45  1  0.637642  0.828957  0.295401  1
  P  P46  1  0.917648  0.172775  0.419746  1
  P  P47  1  0.947619  0.506262  0.372127  1
  P  P48  1  0.978915  0.839143  0.324256  1
  P  P49  1  0.964014  0.322910  0.354437  1
  P  P50  1  0.992667  0.655632  0.306749  1
  P  P51  1  0.934044  0.989424  0.402056  1
  P  P52  1  0.621246  0.012309  0.313091  1
  P  P53  1  0.561305  0.345336  0.408329  1
  P  P54  1  0.591276  0.678822  0.360710  1
  P  P55  1  0.936156  0.290306  0.307965  1
  P  P56  1  0.876215  0.623333  0.403203  1
  P  P57  1  0.906185  0.956820  0.355584  1
  P  P58  1  0.649105  0.044913  0.359563  1
  P  P59  1  0.679157  0.378400  0.311916  1
  P  P60  1  0.619134  0.711427  0.407182  1
  P  P61  1  0.797578  0.287493  0.345508  1
  P  P62  1  0.830100  0.621035  0.298004  1
  P  P63  1  0.767607  0.954006  0.393127  1
  P  P64  1  0.787683  0.047726  0.322020  1
  P  P65  1  0.727742  0.380754  0.417258  1
  P  P66  1  0.757712  0.714240  0.369639  1
  P  P67  1  0.956811  0.259217  0.354669  1
  P  P68  1  0.985630  0.593413  0.306976  1
  P  P69  1  0.926841  0.925730  0.402288  1
  P  P70  1  0.628449  0.076002  0.312859  1
  P  P71  1  0.568508  0.409030  0.408097  1
  P  P72  1  0.598479  0.742516  0.360478  1
  P  P73  1  0.203351  0.228438  0.478264  1
  P  P74  1  0.233322  0.561925  0.430645  1
  P  P75  1  0.173380  0.894952  0.525883  1
  P  P76  1  0.202086  0.105863  0.474978  1
  P  P77  1  0.142145  0.438890  0.570216  1
  P  P78  1  0.172115  0.772376  0.522597  1
  P  P79  1  0.176986  0.271491  0.439739  1
  P  P80  1  0.117044  0.604519  0.534977  1
  P  P81  1  0.147015  0.938005  0.487358  1
  P  P82  1  0.228451  0.062810  0.513503  1
  P  P83  1  0.258422  0.396296  0.465884  1
  P  P84  1  0.198480  0.729323  0.561122  1
  P  P85  1  0.349392  0.270356  0.462755  1
  P  P86  1  0.289451  0.603383  0.557993  1
  P  P87  1  0.319422  0.936869  0.510374  1
  P  P88  1  0.056045  0.063945  0.490487  1
  P  P89  1  0.086015  0.397432  0.442868  1
  P  P90  1  0.026074  0.730459  0.538106  1
  P  P91  1  0.204433  0.290091  0.491388  1
  P  P92  1  0.234404  0.623577  0.443769  1
  P  P93  1  0.174463  0.956604  0.539007  1
  P  P94  1  0.201004  0.044210  0.461854  1
  P  P95  1  0.141062  0.377238  0.557092  1
  P  P96  1  0.171033  0.710724  0.509473  1
  P  P97  1  0.595559  0.186406  0.440794  1
  P  P98  1  0.535618  0.519433  0.536032  1
  P  P99  1  0.565589  0.852920  0.488413  1
  P  P100  1  0.809877  0.147895  0.512448  1
  P  P101  1  0.839848  0.481381  0.464829  1
  P  P102  1  0.779907  0.814409  0.560067  1
  P  P103  1  0.333572  0.178301  0.559720  1
  P  P104  1  0.363543  0.511787  0.512101  1
  P  P105  1  0.393514  0.845273  0.464482  1
  P  P106  1  0.981952  0.155541  0.536379  1
  P  P107  1  0.011923  0.489028  0.488760  1
  P  P108  1  0.041894  0.822514  0.441141  1
  P  P109  1  0.467501  0.223216  0.541832  1
  P  P110  1  0.497472  0.556703  0.494213  1
  P  P111  1  0.527443  0.890189  0.446594  1
  P  P112  1  0.848023  0.110626  0.554267  1
  P  P113  1  0.877994  0.444112  0.506648  1
  P  P114  1  0.907965  0.777598  0.459029  1
  P  P115  1  0.487788  0.161526  0.533496  1
  P  P116  1  0.517759  0.495012  0.485877  1
  P  P117  1  0.547730  0.828498  0.438258  1
  P  P118  1  0.827736  0.172316  0.562603  1
  P  P119  1  0.857707  0.505803  0.514984  1
  P  P120  1  0.887678  0.839289  0.467365  1
  P  P121  1  0.874102  0.322451  0.497294  1
  P  P122  1  0.904073  0.655938  0.449675  1
  P  P123  1  0.844132  0.988965  0.544913  1
  P  P124  1  0.531334  0.011850  0.455948  1
  P  P125  1  0.471393  0.344877  0.551186  1
  P  P126  1  0.501364  0.678363  0.503567  1
  P  P127  1  0.846244  0.289847  0.450822  1
  P  P128  1  0.786302  0.622874  0.546060  1
  P  P129  1  0.816273  0.956361  0.498441  1
  P  P130  1  0.559193  0.044454  0.502420  1
  P  P131  1  0.589164  0.377940  0.454801  1
  P  P132  1  0.529222  0.710968  0.550039  1
  P  P133  1  0.707666  0.287034  0.488365  1
  P  P134  1  0.737637  0.620520  0.440746  1
  P  P135  1  0.677695  0.953547  0.535984  1
  P  P136  1  0.697771  0.047267  0.464877  1
  P  P137  1  0.637830  0.380295  0.560115  1
  P  P138  1  0.667800  0.713781  0.512496  1
  P  P139  1  0.866899  0.258758  0.497526  1
  P  P140  1  0.896870  0.592244  0.449907  1
  P  P141  1  0.836929  0.925271  0.545145  1
  P  P142  1  0.538537  0.075543  0.455716  1
  P  P143  1  0.478596  0.408571  0.550954  1
  P  P144  1  0.508567  0.742057  0.503335  1
  P  P145  1  0.113439  0.227979  0.621121  1
  P  P146  1  0.143409  0.561466  0.573502  1
  P  P147  1  0.083468  0.894493  0.668740  1
  P  P148  1  0.112174  0.105404  0.617835  1
  P  P149  1  0.052087  0.436307  0.712659  1
  P  P150  1  0.082203  0.771917  0.665454  1
  P  P151  1  0.087074  0.271032  0.582596  1
  P  P152  1  0.032925  0.603997  0.678607  1
  P  P153  1  0.057103  0.937546  0.630215  1
  P  P154  1  0.138539  0.062351  0.656360  1
  P  P155  1  0.168510  0.395837  0.608741  1
  P  P156  1  0.108568  0.728864  0.703979  1
  P  P157  1  0.259480  0.269897  0.605612  1
  P  P158  1  0.193532  0.602940  0.700105  1
  P  P159  1  0.229510  0.936410  0.653231  1
  P  P160  1  0.966133  0.063486  0.633344  1
  P  P161  1  0.996103  0.396973  0.585725  1
  P  P162  1  0.936162  0.730000  0.680964  1
  P  P163  1  0.114521  0.289632  0.634245  1
  P  P164  1  0.144492  0.623118  0.586626  1
  P  P165  1  0.084550  0.956145  0.681864  1
  P  P166  1  0.111092  0.043751  0.604711  1
  P  P167  1  0.051082  0.378857  0.700392  1
  P  P168  1  0.081121  0.710265  0.652330  1
  P  P169  1  0.505647  0.185947  0.583651  1
  P  P170  1  0.445706  0.518974  0.678889  1
  P  P171  1  0.475677  0.852461  0.631270  1
  P  P172  1  0.719965  0.147436  0.655305  1
  P  P173  1  0.749936  0.480922  0.607686  1
  P  P174  1  0.690200  0.813944  0.702949  1
  P  P175  1  0.246011  0.178056  0.702274  1
  P  P176  1  0.273631  0.511328  0.654958  1
  P  P177  1  0.303602  0.844814  0.607339  1
  P  P178  1  0.892040  0.155082  0.679236  1
  P  P179  1  0.922011  0.488569  0.631617  1
  P  P180  1  0.951982  0.822055  0.583998  1
  P  P181  1  0.376769  0.221933  0.684766  1
  P  P182  1  0.407560  0.556244  0.637070  1
  P  P183  1  0.437531  0.889730  0.589451  1
  P  P184  1  0.758111  0.110167  0.697124  1
  P  P185  1  0.788082  0.443653  0.649505  1
  P  P186  1  0.818053  0.777140  0.601886  1
  P  P187  1  0.396551  0.161672  0.676605  1
  P  P188  1  0.427847  0.494553  0.628734  1
  P  P189  1  0.457818  0.828039  0.581115  1
  P  P190  1  0.737824  0.171857  0.705460  1
  P  P191  1  0.767795  0.505344  0.657841  1
  P  P192  1  0.797766  0.838830  0.610222  1
  P  P193  1  0.784190  0.321993  0.640151  1
  P  P194  1  0.814161  0.655479  0.592532  1
  P  P195  1  0.754220  0.988506  0.687770  1
  P  P196  1  0.441422  0.011391  0.598805  1
  P  P197  1  0.382799  0.345183  0.694112  1
  P  P198  1  0.411452  0.677904  0.646424  1
  P  P199  1  0.756332  0.289388  0.593679  1
  P  P200  1  0.696309  0.622414  0.688945  1
  P  P201  1  0.726361  0.955902  0.641298  1
  P  P202  1  0.469281  0.043995  0.645277  1
  P  P203  1  0.499252  0.377481  0.597658  1
  P  P204  1  0.439310  0.710509  0.692896  1
  P  P205  1  0.617754  0.286575  0.631222  1
  P  P206  1  0.647725  0.620061  0.583603  1
  P  P207  1  0.587783  0.953088  0.678841  1
  P  P208  1  0.607859  0.046808  0.607734  1
  P  P209  1  0.545366  0.379780  0.702857  1
  P  P210  1  0.577888  0.713322  0.655353  1
  P  P211  1  0.776987  0.258299  0.640383  1
  P  P212  1  0.806958  0.591785  0.592764  1
  P  P213  1  0.747017  0.924812  0.688002  1
  P  P214  1  0.448625  0.075084  0.598573  1
  P  P215  1  0.389836  0.407401  0.693885  1
  P  P216  1  0.418655  0.741598  0.646192  1
