# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   22.17737883
_cell_length_b   95.34634258
_cell_length_c   46.86828939
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   88.32899521
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P208
_cell_volume   99062.3511199
_cell_formula_units_Z   208
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  0.013603  0.013478  0.296024  1
  P  P2  1  0.263603  0.013478  0.296024  1
  P  P3  1  0.513603  0.013478  0.296024  1
  P  P4  1  0.763603  0.013478  0.296024  1
  P  P5  1  0.928040  0.514181  0.305744  1
  P  P6  1  0.178040  0.514181  0.305744  1
  P  P7  1  0.428040  0.514181  0.305744  1
  P  P8  1  0.678040  0.514181  0.305744  1
  P  P9  1  0.963866  0.485944  0.272485  1
  P  P10  1  0.213866  0.485944  0.272485  1
  P  P11  1  0.463866  0.485944  0.272485  1
  P  P12  1  0.713866  0.485944  0.272485  1
  P  P13  1  0.888257  0.999801  0.322887  1
  P  P14  1  0.138257  0.999801  0.322887  1
  P  P15  1  0.388257  0.999801  0.322887  1
  P  P16  1  0.638257  0.999801  0.322887  1
  P  P17  1  0.875519  0.030440  0.339558  1
  P  P18  1  0.125519  0.030440  0.339558  1
  P  P19  1  0.375519  0.030440  0.339558  1
  P  P20  1  0.625519  0.030440  0.339558  1
  P  P21  1  0.801441  0.515381  0.341561  1
  P  P22  1  0.051441  0.515381  0.341561  1
  P  P23  1  0.301441  0.515381  0.341561  1
  P  P24  1  0.551441  0.515381  0.341561  1
  P  P25  1  0.838214  0.487675  0.306113  1
  P  P26  1  0.088214  0.487675  0.306113  1
  P  P27  1  0.338214  0.487675  0.306113  1
  P  P28  1  0.588214  0.487675  0.306113  1
  P  P29  1  0.764851  0.983250  0.332699  1
  P  P30  1  0.014851  0.983250  0.332699  1
  P  P31  1  0.264851  0.983250  0.332699  1
  P  P32  1  0.514851  0.983250  0.332699  1
  P  P33  1  0.754533  0.014481  0.360624  1
  P  P34  1  1.004533  0.014481  0.360624  1
  P  P35  1  0.254533  0.014481  0.360624  1
  P  P36  1  0.504533  0.014481  0.360624  1
  P  P37  1  0.676251  0.515319  0.376898  1
  P  P38  1  0.926251  0.515319  0.376898  1
  P  P39  1  0.176251  0.515319  0.376898  1
  P  P40  1  0.426251  0.515319  0.376898  1
  P  P41  1  0.714221  0.486646  0.342314  1
  P  P42  1  0.964221  0.486646  0.342314  1
  P  P43  1  0.214221  0.486646  0.342314  1
  P  P44  1  0.464221  0.486646  0.342314  1
  P  P45  1  0.639167  0.974954  0.368700  1
  P  P46  1  0.889167  0.974954  0.368700  1
  P  P47  1  0.139167  0.974954  0.368700  1
  P  P48  1  0.389167  0.974954  0.368700  1
  P  P49  1  0.631198  0.006710  0.393584  1
  P  P50  1  0.881198  0.006710  0.393584  1
  P  P51  1  0.131198  0.006710  0.393584  1
  P  P52  1  0.381198  0.006710  0.393584  1
  P  P53  1  0.550916  0.515771  0.412973  1
  P  P54  1  0.800916  0.515771  0.412973  1
  P  P55  1  0.050916  0.515771  0.412973  1
  P  P56  1  0.300916  0.515771  0.412973  1
  P  P57  1  0.589358  0.487384  0.377877  1
  P  P58  1  0.839358  0.487384  0.377877  1
  P  P59  1  0.089358  0.487384  0.377877  1
  P  P60  1  0.339358  0.487384  0.377877  1
  P  P61  1  0.510796  0.986185  0.401056  1
  P  P62  1  0.760796  0.986185  0.401056  1
  P  P63  1  0.010796  0.986185  0.401056  1
  P  P64  1  0.260796  0.986185  0.401056  1
  P  P65  1  0.505089  0.017022  0.429364  1
  P  P66  1  0.755089  0.017022  0.429364  1
  P  P67  1  1.005089  0.017022  0.429364  1
  P  P68  1  0.255089  0.017022  0.429364  1
  P  P69  1  0.425784  0.516012  0.448736  1
  P  P70  1  0.675784  0.516012  0.448736  1
  P  P71  1  0.925784  0.516012  0.448736  1
  P  P72  1  0.175784  0.516012  0.448736  1
  P  P73  1  0.464645  0.487540  0.413921  1
  P  P74  1  0.714645  0.487540  0.413921  1
  P  P75  1  0.964645  0.487540  0.413921  1
  P  P76  1  0.214645  0.487540  0.413921  1
  P  P77  1  0.386392  0.980006  0.437444  1
  P  P78  1  0.636392  0.980006  0.437444  1
  P  P79  1  0.886392  0.980006  0.437444  1
  P  P80  1  0.136392  0.980006  0.437444  1
  P  P81  1  0.381156  0.010836  0.464942  1
  P  P82  1  0.631156  0.010836  0.464942  1
  P  P83  1  0.881156  0.010836  0.464942  1
  P  P84  1  0.131156  0.010836  0.464942  1
  P  P85  1  0.300686  0.516318  0.484621  1
  P  P86  1  0.550686  0.516318  0.484621  1
  P  P87  1  0.800686  0.516318  0.484621  1
  P  P88  1  0.050686  0.516318  0.484621  1
  P  P89  1  0.339703  0.487877  0.449686  1
  P  P90  1  0.589703  0.487877  0.449686  1
  P  P91  1  0.839703  0.487877  0.449686  1
  P  P92  1  0.089703  0.487877  0.449686  1
  P  P93  1  0.259755  0.989921  0.471012  1
  P  P94  1  0.509755  0.989921  0.471012  1
  P  P95  1  0.759755  0.989921  0.471012  1
  P  P96  1  0.009755  0.989921  0.471012  1
  P  P97  1  0.254806  0.020905  0.498756  1
  P  P98  1  0.504806  0.020905  0.498756  1
  P  P99  1  0.754806  0.020905  0.498756  1
  P  P100  1  1.004806  0.020905  0.498756  1
  P  P101  1  0.175649  0.516610  0.520437  1
  P  P102  1  0.425649  0.516610  0.520437  1
  P  P103  1  0.675649  0.516610  0.520437  1
  P  P104  1  0.925649  0.516610  0.520437  1
  P  P105  1  0.214727  0.488157  0.485569  1
  P  P106  1  0.464727  0.488157  0.485569  1
  P  P107  1  0.714727  0.488157  0.485569  1
  P  P108  1  0.964727  0.488157  0.485569  1
  P  P109  1  0.135570  0.983861  0.507250  1
  P  P110  1  0.385570  0.983861  0.507250  1
  P  P111  1  0.635570  0.983861  0.507250  1
  P  P112  1  0.885570  0.983861  0.507250  1
  P  P113  1  0.130622  0.014846  0.534995  1
  P  P114  1  0.380622  0.014846  0.534995  1
  P  P115  1  0.630622  0.014846  0.534995  1
  P  P116  1  0.880622  0.014846  0.534995  1
  P  P117  1  0.050673  0.516889  0.556320  1
  P  P118  1  0.300673  0.516889  0.556320  1
  P  P119  1  0.550673  0.516889  0.556320  1
  P  P120  1  0.800673  0.516889  0.556320  1
  P  P121  1  0.089690  0.488448  0.521386  1
  P  P122  1  0.339690  0.488448  0.521386  1
  P  P123  1  0.589690  0.488448  0.521386  1
  P  P124  1  0.839690  0.488448  0.521386  1
  P  P125  1  0.009220  0.993930  0.541064  1
  P  P126  1  0.259220  0.993930  0.541064  1
  P  P127  1  0.509220  0.993930  0.541064  1
  P  P128  1  0.759220  0.993930  0.541064  1
  P  P129  1  1.003984  0.024760  0.568563  1
  P  P130  1  0.253984  0.024760  0.568563  1
  P  P131  1  0.503984  0.024760  0.568563  1
  P  P132  1  0.753984  0.024760  0.568563  1
  P  P133  1  0.925732  0.517227  0.592085  1
  P  P134  1  0.175732  0.517227  0.592085  1
  P  P135  1  0.425732  0.517227  0.592085  1
  P  P136  1  0.675732  0.517227  0.592085  1
  P  P137  1  0.964593  0.488754  0.557270  1
  P  P138  1  0.214593  0.488754  0.557270  1
  P  P139  1  0.464593  0.488754  0.557270  1
  P  P140  1  0.714593  0.488754  0.557270  1
  P  P141  1  0.885287  0.987745  0.576642  1
  P  P142  1  0.135287  0.987745  0.576642  1
  P  P143  1  0.385287  0.987745  0.576642  1
  P  P144  1  0.635287  0.987745  0.576642  1
  P  P145  1  0.879581  0.018581  0.604950  1
  P  P146  1  0.129581  0.018581  0.604950  1
  P  P147  1  0.379581  0.018581  0.604950  1
  P  P148  1  0.629581  0.018581  0.604950  1
  P  P149  1  0.801019  0.517382  0.628129  1
  P  P150  1  0.051019  0.517382  0.628129  1
  P  P151  1  0.301019  0.517382  0.628129  1
  P  P152  1  0.551019  0.517382  0.628129  1
  P  P153  1  0.839460  0.488995  0.593034  1
  P  P154  1  0.089460  0.488995  0.593034  1
  P  P155  1  0.339460  0.488995  0.593034  1
  P  P156  1  0.589460  0.488995  0.593034  1
  P  P157  1  0.759178  0.998056  0.612422  1
  P  P158  1  0.009178  0.998056  0.612422  1
  P  P159  1  0.259178  0.998056  0.612422  1
  P  P160  1  0.509178  0.998056  0.612422  1
  P  P161  1  0.751209  0.029812  0.637307  1
  P  P162  1  1.001209  0.029812  0.637307  1
  P  P163  1  0.251209  0.029812  0.637307  1
  P  P164  1  0.501209  0.029812  0.637307  1
  P  P165  1  0.676156  0.518120  0.663692  1
  P  P166  1  0.926156  0.518120  0.663692  1
  P  P167  1  0.176156  0.518120  0.663692  1
  P  P168  1  0.426156  0.518120  0.663692  1
  P  P169  1  0.714125  0.489447  0.629108  1
  P  P170  1  0.964125  0.489447  0.629108  1
  P  P171  1  0.214125  0.489447  0.629108  1
  P  P172  1  0.464125  0.489447  0.629108  1
  P  P173  1  0.635843  0.990285  0.645383  1
  P  P174  1  0.885843  0.990285  0.645383  1
  P  P175  1  0.135843  0.990285  0.645383  1
  P  P176  1  0.385843  0.990285  0.645383  1
  P  P177  1  0.625525  0.021516  0.673307  1
  P  P178  1  0.875525  0.021516  0.673307  1
  P  P179  1  0.125525  0.021516  0.673307  1
  P  P180  1  0.375525  0.021516  0.673307  1
  P  P181  1  0.552162  0.517092  0.699893  1
  P  P182  1  0.802162  0.517092  0.699893  1
  P  P183  1  0.052162  0.517092  0.699893  1
  P  P184  1  0.302162  0.517092  0.699893  1
  P  P185  1  0.588935  0.489385  0.664445  1
  P  P186  1  0.838935  0.489385  0.664445  1
  P  P187  1  0.088935  0.489385  0.664445  1
  P  P188  1  0.338935  0.489385  0.664445  1
  P  P189  1  0.514858  0.974326  0.666449  1
  P  P190  1  0.764858  0.974326  0.666449  1
  P  P191  1  0.014858  0.974326  0.666449  1
  P  P192  1  0.264858  0.974326  0.666449  1
  P  P193  1  0.502119  1.004965  0.683120  1
  P  P194  1  0.752119  1.004965  0.683120  1
  P  P195  1  1.002119  1.004965  0.683120  1
  P  P196  1  0.252119  1.004965  0.683120  1
  P  P197  1  0.426510  0.518822  0.733522  1
  P  P198  1  0.676510  0.518822  0.733522  1
  P  P199  1  0.926510  0.518822  0.733522  1
  P  P200  1  0.176510  0.518822  0.733522  1
  P  P201  1  0.462336  0.490585  0.700262  1
  P  P202  1  0.712336  0.490585  0.700262  1
  P  P203  1  0.962336  0.490585  0.700262  1
  P  P204  1  0.212336  0.490585  0.700262  1
  P  P205  1  0.376773  0.991288  0.709982  1
  P  P206  1  0.626773  0.991288  0.709982  1
  P  P207  1  0.876773  0.991288  0.709982  1
  P  P208  1  0.126773  0.991288  0.709982  1
